SCHEMBL2994883

SCHEMBL2994883

Cc1ccccc1C(C)c1ccccc1Cc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.42
CNR2 P34972 1/20 0.41
GPR55 Q9Y2T6 1/20 0.41
HTR2A P28223 1/20 0.40
ESR1 P03372 1/20 0.39
CALM1 P0DP23 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
TSHR P16473 1/20 0.39
CYP2C19 P33261 1/20 0.39
BCL2 P10415 1/20 0.38
BCL2L1 Q07817 1/20 0.38
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
LDHA P00338 1/20 0.38
LDHB P07195 1/20 0.38
TAAR1 Q96RJ0 1/20 0.37
SLC18A2 Q05940 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
SCHEMBL9621605 0.83 SMN1; SMN2 (0.39) L3MBTL1HTR2ACYP3A4CYP2D6TSHR
SCHEMBL4657385 0.83 L3MBTL1 (0.44) L3MBTL1HTR2ACALM1BCL2BCL2L1
SCHEMBL9621607 0.82 TAAR1 (0.42) CNR2GPR55ESR1TSHRTAAR1
SCHEMBL9498584 0.82 POLB (0.50) L3MBTL1CYP3A4TSHRBCL2BCL2L1
SCHEMBL6546213 0.81 ESR1 (0.42) L3MBTL1ESR1TSHRTAAR1
SCHEMBL6546687 0.80 L3MBTL1 (0.47) L3MBTL1CNR2GPR55HTR2ACALM1
SCHEMBL146510 0.79 ESR1 (0.56) ESR1CYP3A4CYP2D6TSHRCYP2C19
Diphenylmethane SCHEMBL10899653 0.79 CALM1 (0.46) CNR2GPR55CALM1CYP3A4CYP2D6
SCHEMBL21471624 0.79 L3MBTL1 (0.46) L3MBTL1HTR2ACALM1CYP2D6BCL2
Hydrogen Peroxide SCHEMBL29140083 0.79 L3MBTL1 (0.50) L3MBTL1CNR2GPR55HTR2ACALM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-61081492-A None JP disclosed
US-8230986-B2 Torque limiter JTEKT CORPORATION (JP) 2012-07-31 US disclosed
US-8220609-B2 Torque limiter JTEKT CORPORATION (JP) 2012-07-17 US disclosed
US-20100184519-A1 TORQUE LIMITER JTEKT CORPORATION (JP) 2010-07-22 US disclosed
JP-S6181492-A LUBRICANT OIL FOR TRANSMISSION NIPPON STEEL CHEM CO LTD 1986-04-25 JP disclosed
JP-S06181492-A 0001-01-01 JP disclosed