SCHEMBL9503388

SCHEMBL9503388

CCOc1c(F)c(F)c(-c2c(F)c(F)c(OC(=O)C3CCC(CC)CC3)c(F)c2F)c(F)c1F

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.34
SMN1; SMN2 Q16637 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
CYP19A1 P11511 1/20 0.32
KDM4E B2RXH2 1/20 0.30
POLB P06746 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL9503381 1.00 HPGD (0.34) HPGDSMN1; SMN2MEN1KMT2ACYP19A1
SCHEMBL9506507 0.87 MAPT (0.38) HPGDMEN1KMT2APOLB
SCHEMBL9503334 0.86 KDM4E (0.30) SMN1; SMN2KDM4EPOLBTSHR
SCHEMBL9503344 0.86 KDM4E (0.30) SMN1; SMN2KDM4EPOLBTSHR
SCHEMBL9502558 0.86 PKM (0.39) HPGDMEN1KMT2APOLB
SCHEMBL9504314 0.86 CCNE2 (0.34)
SCHEMBL9505805 0.85 HTT (0.40) HPGDSMN1; SMN2MEN1KMT2APOLB
SCHEMBL9505784 0.85 HTT (0.40) HPGDSMN1; SMN2MEN1KMT2APOLB
SCHEMBL9502720 0.85 HTT (0.40) HPGDSMN1; SMN2MEN1KMT2APOLB
SCHEMBL9504354 0.85 PPARG (0.34)

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
EP-0364548-B1 OCTAFLUOROBIPHENYLS MERCK PATENT GmbH (DE) 1993-06-09 EP disclosed