SCHEMBL11199829

SCHEMBL11199829

Cc1ccccc1Cc1ccccc1-c1ccc(C)c(C)c1C

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ P2RX7 Q99572 2/20 0.39
▸ TAAR1 Q96RJ0 1/20 0.38
▸ CNR2 P34972 2/20 0.36
▸ GPR55 Q9Y2T6 2/20 0.36
▸ CNR1 P21554 1/20 0.35
▸ PDCD1 Q15116 1/20 0.34
▸ CD274 Q9NZQ7 1/20 0.34
▸ AR P10275 1/20 0.34
▸ POLB P06746 1/20 0.33
▸ CHRM2 P08172 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ CA12 O43570 1/20 0.33
▸ CA1 P00915 1/20 0.33
▸ CA9 Q16790 1/20 0.33
▸ TYMP P19971 1/20 0.33
▸ PTGS1 P23219 1/20 0.33
▸ PTGS2 P35354 1/20 0.33
▸ LTA4H P09960 1/20 0.33

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
SCHEMBL11202179 0.89 P2RX7 (0.47) P2RX7TAAR1CNR2GPR55CNR1
SCHEMBL11201350 0.82 TAAR1 (0.45) P2RX7TAAR1CNR2GPR55AR
SCHEMBL27481617 0.79 PDCD1 (0.52) PDCD1CD274POLB
SCHEMBL11206710 0.79 TAAR1 (0.42) TAAR1CNR2GPR55ARCA12
SCHEMBL11724107 0.78 TSHR (0.43) CD274POLB
SCHEMBL29477327 0.77 TAAR1 (0.56) P2RX7TAAR1CNR2GPR55AR
SCHEMBL2090458 0.77 TAAR1 (0.56) P2RX7TAAR1CNR2GPR55AR
SCHEMBL6546855 0.76 TAAR1 (0.46) P2RX7TAAR1CNR2GPR55CNR1
SCHEMBL11200954 0.75 TAAR1 (0.54) P2RX7TAAR1CNR2GPR55AR
SCHEMBL29772212 0.75 TAAR1 (0.54) P2RX7TAAR1CNR2GPR55AR

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-4371726-A Composition suitable for mechanical power transmission and process for operating traction drives NIPPON STEEL CHEMICAL CO., LTD. (JP) 1983-02-01 — — US disclosed
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