SCHEMBL6546756

SCHEMBL6546756

CCCc1ccccc1Cc1ccccc1C

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.48
HTR2A P28223 1/20 0.41
KMT2A Q03164 1/20 0.40
LTA4H P09960 1/20 0.39
CNR1 P21554 2/20 0.39
CNR2 P34972 2/20 0.39
CTBP2 P56545 1/20 0.38
AR P10275 1/20 0.38
TSHR P16473 1/20 0.38
ACHE P22303 1/20 0.38
GPR55 Q9Y2T6 1/20 0.37
CHRM2 P08172 1/20 0.37
PTGS1 P23219 1/20 0.37
PTGS2 P35354 1/20 0.37
MAPT P10636 1/20 0.37
P2RX7 Q99572 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
SCHEMBL8101085 0.92 LTA4H (0.47) TAAR1HTR2AKMT2ALTA4HCNR1
SCHEMBL5437047 0.89 HTR2A (0.43) TAAR1HTR2A
SCHEMBL6546227 0.88 TAAR1 (0.45) TAAR1HTR2AKMT2ACNR1CNR2
SCHEMBL6546102 0.88 TAAR1 (0.41) TAAR1HTR2AKMT2ACNR1CNR2
SCHEMBL29462889 0.86 TAAR1 (0.62) TAAR1KMT2ACTBP2TSHRACHE
SCHEMBL282555 0.86 TAAR1 (0.62) TAAR1KMT2ACTBP2TSHRACHE
SCHEMBL5496466 0.86 TAAR1 (0.62) TAAR1KMT2ACTBP2TSHRACHE
SCHEMBL11200954 0.86 TAAR1 (0.54) TAAR1KMT2ALTA4HCNR2AR
SCHEMBL8094664 0.86 LIPG (0.50) TAAR1CNR1CNR2GPR55PTGS2
SCHEMBL8093886 0.85 TAAR1 (0.40) TAAR1LTA4HCNR1CNR2GPR55

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
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