SCHEMBL9182186

SCHEMBL9182186

Cc1cc(CCCCCCCCCCc2cc(C)c(O)c(C3CCCCC3)c2)cc(C2CCCCC2)c1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NUDT1 P36639 1/20 0.43
BACE1 P56817 1/20 0.43
KMT2A Q03164 2/20 0.37
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
MAPT P10636 1/20 0.37
PSMB5 P28074 1/20 0.36
CNR1 P21554 4/20 0.36
CNR2 P34972 3/20 0.36
PTGS2 P35354 5/20 0.36
PTGS1 P23219 2/20 0.36
S1PR1 P21453 2/20 0.35
S1PR3 Q99500 2/20 0.35
S1PR5 Q9H228 2/20 0.35
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
PTGDR2 Q9Y5Y4 1/20 0.33
CYP3A4 P08684 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
SCHEMBL9186132 1.00 NUDT1 (0.43) NUDT1BACE1KMT2AKDM4EMEN1
SCHEMBL9178157 1.00 NUDT1 (0.43) NUDT1BACE1KMT2AKDM4EMEN1
SCHEMBL9182097 1.00 NUDT1 (0.43) NUDT1BACE1KMT2AKDM4EMEN1
SCHEMBL9180530 1.00 NUDT1 (0.43) NUDT1BACE1KMT2AKDM4EMEN1
SCHEMBL9177987 1.00 NUDT1 (0.43) NUDT1BACE1KMT2AKDM4EMEN1
SCHEMBL9177928 1.00 NUDT1 (0.43) NUDT1BACE1KMT2AKDM4EMEN1
SCHEMBL9184001 1.00 NUDT1 (0.43) NUDT1BACE1KMT2AKDM4EMEN1
SCHEMBL9182898 0.98 NUDT1 (0.44) NUDT1BACE1KMT2AKDM4EMEN1
SCHEMBL27537865 0.94 PTGS2 (0.45) NUDT1BACE1KDM4ECNR1CNR2
SCHEMBL27480122 0.94 PTGS2 (0.45) NUDT1BACE1KDM4ECNR1CNR2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5473003-A A styrene copolymer blend comprising a stabilizer for heat, oxidation, chemical and actinic radiation resistance CIBA-GEIGY CORPORATION (US) 1995-12-05 US disclosed