SCHEMBL6547231

SCHEMBL6547231

CC(=CCc1ccc(C)cc1)c1ccc(C)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.40
MAOB P27338 1/20 0.40
SRD5A2 P31213 1/20 0.39
ALDH1A1 P00352 5/20 0.39
PKM P14618 2/20 0.39
HTT P42858 2/20 0.39
ATM Q13315 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
LMNA P02545 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
HPGD P15428 1/20 0.39
NLRP1 Q9C000 1/20 0.39
MEN1 O00255 1/20 0.39
NTSR1 P30989 1/20 0.39
KMT2A Q03164 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
IDO1 P14902 3/20 0.38
CES2 O00748 1/20 0.38
CES1 P23141 1/20 0.38
NPC1 O15118 2/20 0.38

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
SCHEMBL6548125 0.90 MEN1 (0.43) ALDH1A1LMNASMN1; SMN2HPGDMEN1
SCHEMBL6547171 0.90 GPR52 (0.44) MAOBALDH1A1SMN1; SMN2HPGDMEN1
SCHEMBL2961734 0.80 TRPA1 (0.44) TRPA1TDP1IDO1
SCHEMBL29626995 0.79 LMNA (0.56) LMNAKMT2A
SCHEMBL10446344 0.78 ALDH1A1 (0.41) MAOBALDH1A1PKMHTTATM
SCHEMBL19073754 0.78 ALDH1A1 (0.41) MAOBALDH1A1PKMHTTATM
SCHEMBL10951122 0.78 ALDH1A1 (0.41) ALDH1A1PKMHTTATMNPSR1
SCHEMBL10446347 0.78 ALDH1A1 (0.41) MAOBALDH1A1PKMHTTATM
SCHEMBL10951124 0.78 ALDH1A1 (0.41) ALDH1A1PKMHTTATMNPSR1
SCHEMBL6546922 0.77 TP53 (0.50) MAOBALDH1A1LMNASMN1; SMN2

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