SCHEMBL6546757

SCHEMBL6546757

Cc1ccccc1CCCCc1ccccc1C

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.65
CHRM2 P08172 1/20 0.48
TSHR P16473 1/20 0.47
ACHE P22303 1/20 0.47
DAO P14920 3/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44
LIPG Q9Y5X9 1/20 0.43
PTGS1 P23219 1/20 0.43
PTGS2 P35354 1/20 0.43
KMT2A Q03164 1/20 0.42
GPR84 Q9NQS5 1/20 0.42
CYP19A1 P11511 1/20 0.41
CYP2A13 Q16696 1/20 0.41
P2RX7 Q99572 1/20 0.41
SLC16A3 O15427 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
SCHEMBL8095309 0.97 TAAR1 (0.62) TAAR1CHRM2TSHRACHEDAO
SCHEMBL8103734 0.97 TAAR1 (0.62) TAAR1CHRM2TSHRACHEDAO
SCHEMBL8098360 0.97 TAAR1 (0.62) TAAR1CHRM2TSHRACHEDAO
SCHEMBL8094982 0.97 TAAR1 (0.62) TAAR1CHRM2TSHRACHEDAO
SCHEMBL8096637 0.97 TAAR1 (0.62) TAAR1CHRM2TSHRACHEDAO
SCHEMBL8086316 0.97 TAAR1 (0.62) TAAR1CHRM2TSHRACHEDAO
SCHEMBL8093093 0.97 TAAR1 (0.62) TAAR1CHRM2TSHRACHEDAO
SCHEMBL8099979 0.97 TAAR1 (0.62) TAAR1CHRM2TSHRACHEDAO
SCHEMBL8093176 0.97 TAAR1 (0.62) TAAR1CHRM2TSHRACHEDAO
SCHEMBL8086531 0.97 TAAR1 (0.62) TAAR1CHRM2TSHRACHEDAO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0717098-B1 A refrigerating machine oil and a fluid composition for use in a refrigerating machine NIPPON MITSUBISHI OIL CORP (JP) 2004-01-21 EP disclosed
EP-0708077-B1 Diamino compounds and methods for preparing them CHISSO CORP (JP) 2000-12-27 EP disclosed
US-5817251-A AROMATIC HYDROCARBON LUBRICANT NIPPON OIL CO., LTD. (JP) 1998-10-06 US disclosed
US-5711895-A Fluid composition for use in a refrigerating machine in which the refrigerating machine oil is at least one hydrocarbon compound of a formula consisting of two phenyl groups joined through an alkylene or alkenylene group NIPPON OIL CO., LTD. (JP) 1998-01-27 US disclosed
US-5663440-A Diamino compounds and methods for preparing them CHISSO CORPORATION (JP) 1997-09-02 US disclosed
EP-0717098-A2 A refrigerating machine oil and a fluid composition for use in a refrigerating machine NIPPON OIL CO. LTD. (JP) 1996-06-19 EP disclosed
EP-0708077-A1 Diamino compounds and methods for preparing them CHISSO CORPORATION (JP) 1996-04-24 EP disclosed