SCHEMBL6739015

SCHEMBL6739015

CNC(=O)Oc1cc(C(C)(C)C)cc(C(C)(C)C)c1.CNC(=O)Oc1cc(C(C)(C)C)cc(C(C)(C)C)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.40
GABRB2 P47870 1/20 0.40
ALDH1A1 P00352 3/20 0.40
BCHE P06276 2/20 0.39
ACHE P22303 2/20 0.39
MAPT P10636 3/20 0.38
HSD17B10 Q99714 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
POLB P06746 1/20 0.38
CYP2D6 P10635 1/20 0.38
KMT2A Q03164 1/20 0.38
ATM Q13315 1/20 0.38
RXRA P19793 1/20 0.37
RXRB P28702 1/20 0.37
RXRG P48443 1/20 0.37
CHRM2 P08172 1/20 0.36
RAF1 P04049 3/20 0.36
TRPV1 Q8NER1 1/20 0.35
TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL77964 1.00 GABRA1 (0.40) GABRA1GABRB2ALDH1A1BCHEACHE
SCHEMBL7530141 0.95 RAF1 (0.39) GABRA1GABRB2ALDH1A1BCHEACHE
SCHEMBL78061 0.82 ACHE (0.51) ALDH1A1BCHEACHEMAPTHSD17B10
SCHEMBL11801182 0.81 MAPT (0.54) ALDH1A1BCHEMAPTHSD17B10KDM4E
Bromide SCHEMBL6851422 0.79 MAPT (0.53) ALDH1A1BCHEMAPTHSD17B10KDM4E
SCHEMBL7175099 0.78 ALDH1A1 (0.38) ALDH1A1BCHEACHEMAPTHSD17B10
SCHEMBL14488840 0.78 CYP3A4 (0.47) GABRA1GABRB2ACHEMAPTHSD17B10
Carbamic Acid SCHEMBL79072 0.77 TRPV1 (0.47) ALDH1A1BCHEACHEMAPTKDM4E
SCHEMBL14220011 0.76 GABRA1 (0.43) GABRA1GABRB2MAPTHSD17B10MEN1
SCHEMBL11464971 0.76 MEN1 (0.47) GABRA1GABRB2ALDH1A1MAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6680065-B2 FOR TREATMENT OF WOODY PLANTS; EMPLOYED IN HOLLOW PREFORMED IN THE WOODY PLANT BAYER AKTIENGESELLSCHAFT (DE) 2004-01-20 US disclosed
US-6528079-B2 For treatment of woody plants; employed in a hollow preformed in the woody plant BAYER AKTIENGESELLSCHAFT (DE) 2003-03-04 US disclosed
US-20020061323-A1 SHAPED BODIES WHICH RELEASE AGROCHEMICAL ACTIVE SUBSTANCES BAYER AKTIENGESELLSCHAFT (DE) 2002-05-23 US disclosed
US-20010039248-A1 Shaped bodies which release agrochemical active substances PODSZUN WOLFGANG (DE) 2001-11-08 US disclosed
EP-0564945-B1 A method of controlling harmful insects BAYER AGROCHEM KK (JP) 2001-01-24 EP disclosed
US-6063393-A RODS OR PINS TO BE PRESSED INTO PLANTS NIHON BAYER AGROCHEM K.K. (JP) 2000-05-16 US disclosed
EP-0564945-A1 A method of controlling harmful insects NIHON BAYER AGROCHEM K.K. (JP) 1993-10-13 EP 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-20020061323-A1 SHAPED BODIES WHICH RELEASE AGROCHEMICAL ACTIVE SUBSTANCES AGL, CHMP4B, GUSB GABRA1 2138/4885GABRB2 2238/4885ALDH1A1 729/4885
US-20010039248-A1 Shaped bodies which release agrochemical active substances AGL, CHMP4B, GUSB GABRA1 2161/4885GABRB2 2238/4885ALDH1A1 758/4885

“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.