SCHEMBL9307469

SCHEMBL9307469

Cc1ccc(-c2ccccc2CC(=O)Cc2ccccc2-c2ccc(C)cc2C)c(C)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.42
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
BAZ2B Q9UIF8 1/20 0.39
BAZ2A Q9UIF9 1/20 0.39
MAPT P10636 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MAPK10 P53779 1/20 0.39
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
ALPL P05186 1/20 0.38
CA9 Q16790 1/20 0.38
GAA P10253 1/20 0.38
TDP1 Q9NUW8 1/20 0.37
MAPK1 P28482 1/20 0.37
HSD11B1 P28845 1/20 0.37
GABRG2 P18507 1/20 0.37
GABRB3 P28472 1/20 0.37
GABRA2 P47869 1/20 0.37
PPARG P37231 1/20 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
SCHEMBL14496002 0.82 CSNK2A2 (0.50) ELANENPC1RAB9AMAPTSMN1; SMN2
SCHEMBL6702122 0.77 MYC (0.58) NPC1RAB9AKMT2AALPLCA9
SCHEMBL14729157 0.76 NPC1 (0.46) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL5849852 0.75 ELANE (0.39) ELANEMAPTSMN1; SMN2MAPK10MEN1
SCHEMBL31190944 0.74 GSK3B (0.43) ELANENPC1RAB9AMAPTMAPK10
SCHEMBL11729295 0.73 ELANE (0.52) ELANENPC1RAB9AMAPTSMN1; SMN2
SCHEMBL29590360 0.73 ELANE (0.52) ELANENPC1RAB9AMAPTSMN1; SMN2
SCHEMBL16672740 0.73 TSHR (0.59) NPC1RAB9AMAPTSMN1; SMN2MAPK10
SCHEMBL4686425 0.72 ALDH1A1 (0.46) MEN1KMT2AGAAMAPK1
SCHEMBL25450668 0.72 ALPL (0.43) NPC1RAB9AMAPTSMN1; SMN2MEN1

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-5284975-A Method of preparing α-d-phenylalkylbenzyl carbinol MALLINCKRODT SPECIALTY CHEMICALS COMPANY (US) 1994-02-08 US claimed