SCHEMBL3868646

SCHEMBL3868646

CCCCCCCCCCCC(=O)NC1CCNCC1

nearest known ligand 0.97

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 4/20 0.97
GNAO1 P09471 4/20 0.97
GNAI1 P63096 4/20 0.97
EPHX1 P07099 1/20 0.63
SMN1; SMN2 Q16637 1/20 0.55
TRPV1 Q8NER1 4/20 0.54
CNR1 P21554 3/20 0.54
CNR2 P34972 3/20 0.54
MEN1 O00255 1/20 0.54
ALDH1A1 P00352 1/20 0.54
MAPT P10636 1/20 0.54
HPGD P15428 1/20 0.54
KMT2A Q03164 1/20 0.54
CCR2 P41597 1/20 0.52
HDAC3 O15379 1/20 0.51
HDAC1 Q13547 1/20 0.51
HDAC2 Q92769 1/20 0.51
HDAC10 Q969S8 1/20 0.51
HDAC11 Q96DB2 1/20 0.51
HDAC8 Q9BY41 1/20 0.51

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3868605 1.00 GNAI3 (0.97) GNAI3GNAO1GNAI1EPHX1SMN1; SMN2
SCHEMBL6381974 1.00 GNAI3 (0.97) GNAI3GNAO1GNAI1EPHX1SMN1; SMN2
SCHEMBL9678249 0.98 GNAI3 (0.94) GNAI3GNAO1GNAI1EPHX1SMN1; SMN2
SCHEMBL13459399 0.93 GNAI3 (0.84) GNAI3GNAO1GNAI1EPHX1SMN1; SMN2
Hydrochloric Acid SCHEMBL11625352 0.92 GNAI3 (0.88) GNAI3GNAO1GNAI1EPHX1SMN1; SMN2
SCHEMBL3869700 0.90 GNAI3 (0.80) GNAI3GNAO1GNAI1EPHX1SMN1; SMN2
SCHEMBL22628361 0.90 GNAI3 (0.80) GNAI3GNAO1GNAI1EPHX1SMN1; SMN2
SCHEMBL3871100 0.90 GNAI3 (0.80) GNAI3GNAO1GNAI1EPHX1SMN1; SMN2
SCHEMBL19750263 0.90 GNAI3 (0.80) GNAI3GNAO1GNAI1EPHX1SMN1; SMN2
SCHEMBL18893060 0.88 GNAI3 (0.76) GNAI3GNAO1GNAI1EPHX1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2077260-B1 AMIDE COMPOUND OR SALT THEREOF, AND BIOFILM FORMATION INHIBITOR, BIOFILM REMOVER AND BACTERICIDE EACH USING THE AMIDE COMPOUND OR SALT THEREOF UNIV TOKYO (JP) 2015-02-18 EP claimed
US-8748617-B2 Amide compound or salt thereof, and biofilm inhibitor, biofilm remover and disinfectant containing the same UNIVERSITY OF TOKYO (JP) 2014-06-10 US claimed
US-9000190-B2 Amide compound or salt thereof, biofilm inhibitor, biofilm remover and disinfectant containing the same UNIVERSITY OF TOKYO (JP) 2015-04-07 US disclosed
US-9000190-B2 Amide compound or salt thereof, biofilm inhibitor, biofilm remover and disinfectant containing the same UNIVERSITY OF TOKYO (JP) 2015-04-07 US disclosed
US-9000190-B2 Amide compound or salt thereof, biofilm inhibitor, biofilm remover and disinfectant containing the same UNIVERSITY OF TOKYO (JP) 2015-04-07 US disclosed
EP-2077260-B1 AMIDE COMPOUND OR SALT THEREOF, AND BIOFILM FORMATION INHIBITOR, BIOFILM REMOVER AND BACTERICIDE EACH USING THE AMIDE COMPOUND OR SALT THEREOF UNIV TOKYO (JP) 2015-02-18 EP disclosed
EP-2077260-B1 AMIDE COMPOUND OR SALT THEREOF, AND BIOFILM FORMATION INHIBITOR, BIOFILM REMOVER AND BACTERICIDE EACH USING THE AMIDE COMPOUND OR SALT THEREOF UNIV TOKYO (JP) 2015-02-18 EP disclosed
US-20150018564-A1 AMIDE COMPOUND OR SALT THEREOF, BIOFILM INHIBITOR, BIOFILM REMOVER AND DISINFECTANT CONTAINING THE SAME UNIVERSITY OF TOKYO (JP) 2015-01-15 US disclosed
US-20150018564-A1 AMIDE COMPOUND OR SALT THEREOF, BIOFILM INHIBITOR, BIOFILM REMOVER AND DISINFECTANT CONTAINING THE SAME UNIVERSITY OF TOKYO (JP) 2015-01-15 US disclosed
US-20150018564-A1 AMIDE COMPOUND OR SALT THEREOF, BIOFILM INHIBITOR, BIOFILM REMOVER AND DISINFECTANT CONTAINING THE SAME UNIVERSITY OF TOKYO (JP) 2015-01-15 US disclosed
US-8748617-B2 Amide compound or salt thereof, and biofilm inhibitor, biofilm remover and disinfectant containing the same UNIVERSITY OF TOKYO (JP) 2014-06-10 US disclosed
US-20120296094-A1 AMIDE COMPOUND OR SALT THEREOF, AND BIOFILM INHIBITOR, BIOFILM REMOVER AND DISINFECTANT CONTAINING THE SAME OTSUKA CHEMICAL CO., LTD. (JP) 2012-11-22 US disclosed
US-20120296094-A1 AMIDE COMPOUND OR SALT THEREOF, AND BIOFILM INHIBITOR, BIOFILM REMOVER AND DISINFECTANT CONTAINING THE SAME OTSUKA CHEMICAL CO., LTD. (JP) 2012-11-22 US disclosed
US-8258307-B2 Amide compound or salt thereof, and biofilm inhibitor, biofilm remover and disinfectant containing the same UNIVERSITY OF TOKYO (JP) 2012-09-04 US disclosed
US-8258307-B2 Amide compound or salt thereof, and biofilm inhibitor, biofilm remover and disinfectant containing the same UNIVERSITY OF TOKYO (JP) 2012-09-04 US disclosed
US-8258307-B2 Amide compound or salt thereof, and biofilm inhibitor, biofilm remover and disinfectant containing the same UNIVERSITY OF TOKYO (JP) 2012-09-04 US disclosed
EP-2077260-A1 AMIDE COMPOUND OR SALT THEREOF, AND BIOFILM FORMATION INHIBITOR, BIOFILM REMOVER AND BACTERICIDE EACH USING THE AMIDE COMPOUND OR SALT THEREOF The University of Tokyo (JP) 2009-07-08 EP disclosed
US-20090068120-A1 AMIDE COMPOUND OR SALT THEREOF, AND BIOFILM INHIBITOR, BIOFILM REMOVER AND DISINFECTANT CONTAINING THE SAME OTSUKA CHEMICAL CO., LTD. (JP) 2009-03-12 US disclosed
US-20090068120-A1 AMIDE COMPOUND OR SALT THEREOF, AND BIOFILM INHIBITOR, BIOFILM REMOVER AND DISINFECTANT CONTAINING THE SAME OTSUKA CHEMICAL CO., LTD. (JP) 2009-03-12 US disclosed
US-20090068120-A1 AMIDE COMPOUND OR SALT THEREOF, AND BIOFILM INHIBITOR, BIOFILM REMOVER AND DISINFECTANT CONTAINING THE SAME OTSUKA CHEMICAL CO., LTD. (JP) 2009-03-12 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150018564-A1 AMIDE COMPOUND OR SALT THEREOF, BIOFILM INHIBITOR, BIOFILM REMOVER AND DISINFECTANT CONTAINING THE SAME Q6ZSR9, F12, H1-0 GNAI3 2508/4885GNAO1 2462/4885GNAI1 1061/4885
US-20090068120-A1 AMIDE COMPOUND OR SALT THEREOF, AND BIOFILM INHIBITOR, BIOFILM REMOVER AND DISINFECTANT CONTAINING THE SAME Q6ZSR9, F12, H1-0 GNAI3 2369/4885GNAO1 2572/4885GNAI1 1109/4885
US-20120296094-A1 AMIDE COMPOUND OR SALT THEREOF, AND BIOFILM INHIBITOR, BIOFILM REMOVER AND DISINFECTANT CONTAINING THE SAME Q6ZSR9, F12, H1-0 GNAI3 2369/4885GNAO1 2572/4885GNAI1 1109/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.