SCHEMBL6546326

SCHEMBL6546326

CCC(C=Cc1ccccc1C)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.38
TSHR P16473 2/20 0.38
LMNA P02545 3/20 0.37
RAB9A P51151 5/20 0.37
KDM4E B2RXH2 5/20 0.37
APOBEC3A P31941 1/20 0.37
APOBEC3G Q9HC16 1/20 0.37
GAA P10253 2/20 0.36
SCN4A P35499 5/20 0.36
MEN1 O00255 1/20 0.36
PABPC1 P11940 1/20 0.36
KMT2A Q03164 1/20 0.36
TP53 P04637 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
THPO P40225 1/20 0.34
HIF1A Q16665 1/20 0.34
NR1H2 P55055 1/20 0.34
NR1H3 Q13133 1/20 0.34
CTSK P43235 1/20 0.34

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
SCHEMBL6546308 1.00 ALDH1A1 (0.38) ALDH1A1TSHRLMNARAB9AKDM4E
SCHEMBL4615602 0.78 MEN1 (0.47) ALDH1A1LMNARAB9AKDM4EMEN1
SCHEMBL4615601 0.78 MEN1 (0.47) ALDH1A1LMNARAB9AKDM4EMEN1
SCHEMBL11285818 0.77 ALDH1A1 (0.42) ALDH1A1TSHRLMNARAB9AKDM4E
SCHEMBL6548122 0.77 ALDH1A1 (0.42) ALDH1A1TSHRLMNARAB9AKDM4E
SCHEMBL6548129 0.77 ALDH1A1 (0.42) ALDH1A1TSHRLMNARAB9AKDM4E
SCHEMBL6546314 0.76 CYP3A4 (0.41) ALDH1A1LMNARAB9AKDM4EMEN1
SCHEMBL5855883 0.74 LMNA (0.45) LMNAMEN1KMT2APOLBNOS3
SCHEMBL5855884 0.74 LMNA (0.45) LMNAMEN1KMT2APOLBNOS3
SCHEMBL6547644 0.72 MEN1 (0.43) ALDH1A1RAB9AMEN1KMT2ACYP1A2

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