SCHEMBL9711013

SCHEMBL9711013

N#Cc1cc(F)c(Oc2cccc3c(O)cccc23)c(F)c1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
AR P10275 2/20 0.37
ESR1 P03372 13/20 0.36
ESR2 Q92731 13/20 0.36
MEN1 O00255 5/20 0.36
KMT2A Q03164 5/20 0.36
GAA P10253 3/20 0.36
JAK2 O60674 1/20 0.36
USP2 O75604 1/20 0.36
MAPT P10636 1/20 0.36
ALOX15 P16050 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
HSD17B10 Q99714 1/20 0.36
POLB P06746 1/20 0.35
CYP11B1 P15538 1/20 0.34
EGLN2 Q96KS0 1/20 0.34
KDM4E B2RXH2 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
SCHEMBL9710658 0.84 AR (0.42) ARESR1ESR2MEN1KMT2A
SCHEMBL9710663 0.82 AR (0.37) ARESR1ESR2MEN1KMT2A
SCHEMBL9314085 0.78 ESR1 (0.37) ESR1ESR2MEN1KMT2AGAA
SCHEMBL9710755 0.76 CYP11B1 (0.49) ARESR1ESR2MEN1KMT2A
SCHEMBL27579557 0.74 AR (0.42) ARESR1ESR2MEN1KMT2A
SCHEMBL9710713 0.73 AR (0.58) ARESR1ESR2MAPT
SCHEMBL8546460 0.73 MAPT (0.42) ARMEN1KMT2AGAAMAPT
SCHEMBL9313692 0.72 HSD17B1 (0.36) ARESR1ESR2MEN1KMT2A
SCHEMBL9710817 0.71 SMN1; SMN2 (0.34) ARGAASMN1; SMN2NPSR1CYP11B1
SCHEMBL12316912 0.70 AR (0.43) ARMEN1KMT2AGAAMAPT

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
WO-1992018467-A1 CYANOPHENOXYNAPHTHYL OXYCARBOXYLIC ACID DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 1992-10-29 WO disclosed