SCHEMBL11777466

SCHEMBL11777466

FCCCCCCCCCOCc1ccc2c(c1)OCO2

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 2/20 0.49
▸ TAAR1 Q96RJ0 1/20 0.47
▸ GBA1 P04062 1/20 0.45
▸ UGCG Q16739 1/20 0.45
▸ GBA2 Q9HCG7 1/20 0.45
▸ CALM1 P0DP23 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ SLC6A4 P31645 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ TSHR P16473 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.41
▸ FAAH O00519 1/20 0.41
▸ MGLL Q99685 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ GAA P10253 1/20 0.41

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
SCHEMBL11773428 0.89 CYP3A4 (0.55) CYP3A4TAAR1CALM1KMT2ASLC6A4
SCHEMBL11775725 0.87 CYP3A4 (0.50) CYP3A4TAAR1GBA1UGCGGBA2
SCHEMBL11775290 0.87 CYP3A4 (0.50) CYP3A4TAAR1GBA1UGCGGBA2
SCHEMBL11780707 0.85 CYP3A4 (0.52) CYP3A4TAAR1GBA1UGCGGBA2
SCHEMBL11774715 0.85 CYP3A4 (0.49) CYP3A4TAAR1GBA1UGCGGBA2
SCHEMBL11778312 0.85 CYP3A4 (0.52) CYP3A4TAAR1GBA1UGCGGBA2
SCHEMBL11775440 0.85 CYP3A4 (0.49) CYP3A4TAAR1GBA1UGCGGBA2
SCHEMBL11773523 0.85 CYP3A4 (0.52) CYP3A4TAAR1GBA1UGCGGBA2
SCHEMBL11778631 0.85 CYP3A4 (0.49) CYP3A4TAAR1GBA1UGCGGBA2
SCHEMBL11773566 0.85 CYP3A4 (0.52) CYP3A4TAAR1GBA1UGCGGBA2

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-3941884-A INSECTICIDE CHEVRON RESEARCH COMPANY (US) 1976-03-02 — — US disclosed
Send feedback