SCHEMBL11323610

SCHEMBL11323610

Cc1ccc(Cc2ccccc2C)c(C)c1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.43
RAB9A P51151 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
LMNA P02545 1/20 0.42
HTT P42858 1/20 0.42
TNF P01375 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
TSHR P16473 1/20 0.42
CYP2C19 P33261 1/20 0.42
NPC1 O15118 1/20 0.42
MAPT P10636 1/20 0.42
CNR2 P34972 2/20 0.41
PYCR1 P32322 1/20 0.41
TYMP P19971 1/20 0.40
GPR55 Q9Y2T6 1/20 0.40

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
SCHEMBL3299248 0.89 PYCR1 (0.47) TAAR1RAB9ASMN1; SMN2LMNAHTT
SCHEMBL6546220 0.88 RAB9A (0.44) RAB9ASMN1; SMN2LMNAHTTTNF
SCHEMBL8086482 0.87 TAAR1 (0.50) TAAR1RAB9ATNFCYP3A4CYP2D6
SCHEMBL6547470 0.87 TAAR1 (0.54) TAAR1RAB9ASMN1; SMN2LMNAHTT
SCHEMBL3301748 0.85 CYP3A4 (0.53) RAB9ASMN1; SMN2LMNAHTTTNF
SCHEMBL7460688 0.84 HSPA5 (0.59) RAB9ASMN1; SMN2HTTCYP2C19NPC1
SCHEMBL21323294 0.84 HTT (0.46) TAAR1RAB9ASMN1; SMN2LMNAHTT
SCHEMBL11194149 0.84 LMNA (0.48) TAAR1RAB9ASMN1; SMN2LMNAHTT
SCHEMBL29155377 0.84 PYCR1 (0.40) RAB9ASMN1; SMN2LMNAHTTTNF
SCHEMBL2090458 0.83 TAAR1 (0.56) TAAR1LMNATSHRCNR2TYMP

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-4263047-A PHENOLIC RESIN OR METAL SALT OF AROMATIC ACID FUJI PHOTO FILM CO., LTD. (JP) 1981-04-21 US disclosed