SCHEMBL9967267

SCHEMBL9967267

Cc1cccc(C(=O)Nc2ccc(F)cc2)n1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.69
NPC1 O15118 4/20 0.62
RAB9A P51151 4/20 0.62
TP53 P04637 2/20 0.62
GBA1 P04062 1/20 0.62
GRM5 P41594 2/20 0.62
GAA P10253 3/20 0.60
SMN1; SMN2 Q16637 3/20 0.60
ALDH1A1 P00352 2/20 0.60
P2RX7 Q99572 1/20 0.57
MEN1 O00255 4/20 0.56
KMT2A Q03164 4/20 0.56
POLB P06746 1/20 0.56
KDM4E B2RXH2 1/20 0.55
LMNA P02545 1/20 0.55
MAPK1 P28482 1/20 0.55
RECQL P46063 1/20 0.55
MCL1 Q07820 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55

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
SCHEMBL13201029 0.85 POLB (0.77) MAPTNPC1RAB9ATP53GBA1
SCHEMBL30761113 0.85 POLB (0.77) MAPTNPC1RAB9ATP53GBA1
SCHEMBL31720835 0.84 RAB9A (0.62) MAPTNPC1RAB9ATP53GBA1
SCHEMBL3158213 0.83 MAPT (0.67) MAPTNPC1RAB9AGAASMN1; SMN2
SCHEMBL27668611 0.81 RAB9A (0.55) MAPTNPC1RAB9ATP53GBA1
SCHEMBL18147634 0.81 MAPT (0.65) MAPTNPC1RAB9ATP53GAA
SCHEMBL20766926 0.81 MAPT (0.65) MAPTNPC1RAB9ATP53GRM5
SCHEMBL6831113 0.79 MAPT (0.62) MAPTNPC1RAB9ATP53GAA
SCHEMBL7065300 0.79 MAPT (0.69) MAPTNPC1RAB9ATP53GAA
SCHEMBL9269873 0.78 MAPT (0.60) MAPTNPC1RAB9AGAASMN1; SMN2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170339961-A1 Molecules having pesticidal utility, and intermediates, compositions, and processes, related thereto DOW AGROSCIENCES LLC (US) 2017-11-30 US disclosed
US-9781935-B2 Molecules having pesticidal utility, and intermediates, compositions, and processes, related thereto DOW AGROSCIENCES LLC (US) 2017-10-10 US disclosed
US-20160304522-A1 Molecules having pesticidal utility, and intermediates, compositions, and processes, related thereto DOW AGROSCIENCES LLC (US) 2016-10-20 US disclosed
WO-2012079583-A1 SYSTEM PROVIDING CONTROLLED DELIVERY OF GASEOUS CO FOR CARBONYLATION REACTIONS AARHUS UNIVERSITET (DK) 2012-06-21 WO 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 (2 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-20160304522-A1 Molecules having pesticidal utility, and intermediates, compositions, and processes, related thereto ACHE, DDT, MLYCD MAPT 3431/4885NPC1 3361/4885RAB9A 567/4885
US-20170339961-A1 Molecules having pesticidal utility, and intermediates, compositions, and processes, related thereto ACHE, DDT, MLYCD MAPT 3431/4885NPC1 3361/4885RAB9A 567/4885

“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.