SCHEMBL10797148

SCHEMBL10797148

CC#CCOC(=O)C(c1ccc(Cl)cc1)C(C)C

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FFAR2 O15552 11/20 0.49
LMNA P02545 3/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 2/20 0.40
CYP3A4 P08684 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
NFKB1 P19838 1/20 0.40
CYP2C19 P33261 1/20 0.40
FFAR1 O14842 1/20 0.40
RAB9A P51151 1/20 0.39
PMP22 Q01453 1/20 0.39
NLRP3 Q96P20 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
SCHEMBL10792700 0.86 ALDH1A1 (0.43) LMNAALDH1A1CYP3A4CYP2D6
SCHEMBL10793206 0.83 PARP10 (0.43) MEN1KMT2A
SCHEMBL10792202 0.82 ADAM17 (0.45)
SCHEMBL10793137 0.81 TAS1R3 (0.41) LMNAMEN1KMT2AKDM4EALDH1A1
SCHEMBL9856031 0.81 FFAR2 (0.41) FFAR2LMNAMEN1KMT2AALDH1A1
SCHEMBL10796119 0.80 CSNK2A1 (0.44) LMNAMEN1KMT2AKDM4ECYP3A4
SCHEMBL10796571 0.80 ALDH1A1 (0.53) FFAR2MEN1KMT2AKDM4EALDH1A1
SCHEMBL23027132 0.80 FFAR2 (0.56) FFAR2LMNAMEN1KMT2AKDM4E
SCHEMBL11062117 0.80 FFAR2 (0.56) FFAR2LMNAMEN1KMT2AKDM4E
SCHEMBL10793252 0.79 RORC (0.42) LMNAMEN1KMT2AALDH1A1CYP1A2

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-4668815-A FROM ACYL HALIDE AND ALCOHOL WITH TIRPLE BOND KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1987-05-26 US disclosed