SCHEMBL8907394

SCHEMBL8907394

CC1CCC(NC(=O)C(Cl)c2ccccc2F)(C(=O)O)CC1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FABP4 P15090 5/20 0.38
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
FABP5 Q01469 2/20 0.36
GPR132 Q9UNW8 1/20 0.35
CYP2C9 P11712 2/20 0.34
CYP2C19 P33261 1/20 0.34
EPHX2 P34913 1/20 0.34
TRPV1 Q8NER1 1/20 0.34
KDM4E B2RXH2 2/20 0.34
NPC1 O15118 1/20 0.34
MAPT P10636 2/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP3A4 P08684 1/20 0.33
TP53 P04637 1/20 0.33
GAA P10253 1/20 0.33
CNR2 P34972 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
SCHEMBL8906834 0.89 HDAC4 (0.38) FABP4MEN1KMT2AFABP5KDM4E
SCHEMBL8907165 0.88 OPRL1 (0.40) FABP4MEN1KMT2AFABP5CYP2C9
SCHEMBL8905504 0.88 MEN1 (0.38) MEN1KMT2ACYP2C9EPHX2TRPV1
SCHEMBL8905523 0.87 OPRL1 (0.40) FABP4MEN1KMT2AFABP5EPHX2
SCHEMBL8906395 0.87 FABP4 (0.36) FABP4MEN1KMT2AFABP5CYP2C9
SCHEMBL8906372 0.87 MEN1 (0.35) FABP4MEN1KMT2AFABP5CYP2C9
SCHEMBL8905912 0.86 MEN1 (0.36) FABP4MEN1KMT2AFABP5EPHX2
SCHEMBL6475347 0.86 GAA (0.42) MEN1KMT2AGPR132EPHX2NPC1
SCHEMBL8907201 0.81 HDAC4 (0.38) MEN1KMT2AKDM4EMAPTALDH1A1
SCHEMBL8906524 0.79 MEN1 (0.36) MEN1KMT2AEPHX2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5677449-A PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1997-10-14 US disclosed
US-5462913-A Pesticides, insecticides, miticides, herbicides BAYER AKTIENGESELLSCHAFT (DE) 1995-10-31 US disclosed