SCHEMBL6546220

SCHEMBL6546220

CCc1ccccc1Cc1ccc(C)cc1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.44
NPC1 O15118 1/20 0.44
KDM4E B2RXH2 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.41
TNF P01375 1/20 0.41
GABRA1 P14867 1/20 0.40
GABRB2 P47870 1/20 0.40
MAPT P10636 1/20 0.40
NR3C1 P04150 1/20 0.39
PGR P06401 1/20 0.39
NR3C2 P08235 1/20 0.39
PYCR1 P32322 1/20 0.39
PSMB5 P28074 2/20 0.38
PSMB8 P28062 1/20 0.38
TSHR P16473 2/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 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
SCHEMBL11323610 0.88 TAAR1 (0.43) RAB9ANPC1SMN1; SMN2LMNAHTT
SCHEMBL6546099 0.87 RAB9A (0.38) RAB9ANPC1KDM4ESMN1; SMN2LMNA
SCHEMBL6546710 0.87 GABRA1 (0.41) RAB9ANPC1KDM4EL3MBTL1SMN1; SMN2
SCHEMBL3299248 0.85 PYCR1 (0.47) RAB9ANPC1KDM4ESMN1; SMN2LMNA
SCHEMBL6547395 0.84 RAB9A (0.44) RAB9ANPC1KDM4EL3MBTL1SMN1; SMN2
SCHEMBL6548002 0.83 TAAR1 (0.46) GABRA1GABRB2TSHRKMT2A
SCHEMBL11210876 0.83 TAAR1 (0.46) GABRA1GABRB2TSHRKMT2A
SCHEMBL168406 0.83 PYCR1 (0.46) RAB9ANPC1KDM4ESMN1; SMN2LMNA
SCHEMBL11875210 0.81 L3MBTL1 (0.45) RAB9ANPC1KDM4EL3MBTL1SMN1; SMN2
SCHEMBL21323294 0.81 HTT (0.46) RAB9ANPC1SMN1; SMN2LMNAHTT

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