SCHEMBL9422155

SCHEMBL9422155

CCCC1Cc2ccccc2C1O

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 8/20 0.42
HTR1A P08908 1/20 0.40
BLM P54132 1/20 0.40
TSHR P16473 1/20 0.40
SIGMAR1 Q99720 2/20 0.37

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
Alcohol SCHEMBL20359081 0.86 OPRM1 (0.41) OPRM1HTR1ABLMTSHR
SCHEMBL24821521 0.85 BLM (0.42) OPRM1BLMTSHRSIGMAR1
SCHEMBL11768481 0.84 BLM (0.44) OPRM1HTR1ABLMTSHR
SCHEMBL8159949 0.81 HTR2A (0.53) OPRM1BLMTSHRSIGMAR1
SCHEMBL6268863 0.81 HTR2A (0.53) OPRM1BLMTSHRSIGMAR1
SCHEMBL9334169 0.81 HTR2A (0.53) OPRM1BLMTSHRSIGMAR1
Dimethylamine SCHEMBL9334171 0.81 SLC6A2 (0.40) OPRM1BLMTSHRSIGMAR1
SCHEMBL17539095 0.79 BLM (0.43) OPRM1BLMTSHR
SCHEMBL4666507 0.79 BLM (0.43) OPRM1BLMTSHR
SCHEMBL2214776 0.78 HTR2A (0.46) BLMTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5329033-A Metallocene catalyst, indene containing ligands, alumoxane cocatalyst HOECHST AKTIENGESELLSCHAFT (DE) 1994-07-12 US disclosed