SCHEMBL6546465

SCHEMBL6546465

C=C(Cc1ccccc1)c1cccc(C)c1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.44
GAA P10253 1/20 0.44
GPR52 Q9Y2T5 2/20 0.43
POLB P06746 1/20 0.42
CRHBP P24387 1/20 0.41
NPBWR1 P48145 1/20 0.41
CRHR2 Q13324 1/20 0.41
MCHR1 Q99705 1/20 0.41
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
HPGD P15428 3/20 0.40
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
AKR1B10 O60218 1/20 0.39
TRPA1 O75762 1/20 0.39
ABCB11 O95342 1/20 0.39
DHFR P00374 1/20 0.39
LMNA P02545 1/20 0.39
MPO P05164 1/20 0.39
CYP1A2 P05177 1/20 0.39

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
SCHEMBL1824047 0.81 SMN1; SMN2 (0.50) SMN1; SMN2GAAPOLBCRHBPNPBWR1
SCHEMBL6548096 0.81 HTT (0.44) SMN1; SMN2GAAGPR52KMT2AMEN1
SCHEMBL21473089 0.79 SMN1; SMN2 (0.47) SMN1; SMN2GAAGPR52CRHBPNPBWR1
SCHEMBL3468225 0.79 SMN1; SMN2 (0.51) SMN1; SMN2GAAPOLBCRHBPNPBWR1
SCHEMBL7714807 0.77 SMN1; SMN2 (0.43) SMN1; SMN2GAAGPR52POLBCRHBP
SCHEMBL22030308 0.77 MAOA (0.42) GAAMAOAMAOBHPGDKMT2A
SCHEMBL11829374 0.76 ESR1 (0.41) SMN1; SMN2MAOAMAOBHPGDKMT2A
SCHEMBL6546473 0.74 NPC1 (0.51) SMN1; SMN2GAAPOLBKMT2AMEN1
SCHEMBL6546320 0.73 HTT (0.45) SMN1; SMN2GAALMNAAKR1B1TDP1
SCHEMBL6547552 0.73 GABRA1 (0.41) POLBMAOAHPGDTRPA1LMNA

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