SCHEMBL6547484

SCHEMBL6547484

CCC(C)c1ccccc1Cc1ccccc1C

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.50
TAAR1 Q96RJ0 1/20 0.38
NR3C1 P04150 1/20 0.36
PGR P06401 1/20 0.36
NR3C2 P08235 1/20 0.36
KMT2A Q03164 1/20 0.36
ESR1 P03372 1/20 0.35
AR P10275 1/20 0.34
CNR2 P34972 1/20 0.33
GPR55 Q9Y2T6 1/20 0.33
P2RX7 Q99572 1/20 0.33
CHRM2 P08172 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 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
SCHEMBL24631776 0.84 TAAR1 (0.46) TAAR1ESR1ARALDH1A1HPGD
SCHEMBL5664115 0.83 TSHR (0.52) TSHRTAAR1
SCHEMBL9621607 0.82 TAAR1 (0.42) TSHRTAAR1KMT2AESR1AR
SCHEMBL6546915 0.82 TAAR1 (0.42) TSHRTAAR1KMT2AESR1AR
SCHEMBL6547477 0.82 TSHR (0.47) TSHRKMT2AALDH1A1HPGD
SCHEMBL24958957 0.81 TAAR1 (0.47) TAAR1ESR1ARALDH1A1HPGD
SCHEMBL29654913 0.80 TSHR (0.61) TSHRNR3C2ESR1CHRM2
SCHEMBL5357776 0.80 TSHR (0.61) TSHRNR3C2ESR1CHRM2
SCHEMBL5496564 0.80 TSHR (0.61) TSHRNR3C2ESR1CHRM2
SCHEMBL793225 0.80 TSHR (0.61) TSHRNR3C2ESR1CHRM2

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 4 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
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
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