SCHEMBL9710663

SCHEMBL9710663

N#Cc1cc(F)c(Oc2cccc3c(O)cccc23)c(F)c1F

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 5/20 0.37
ESR1 P03372 11/20 0.34
ESR2 Q92731 11/20 0.34
MEN1 O00255 5/20 0.34
KMT2A Q03164 5/20 0.34
GAA P10253 3/20 0.34
MAPT P10636 2/20 0.34
JAK2 O60674 1/20 0.34
USP2 O75604 1/20 0.34
ALOX15 P16050 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
HSD17B10 Q99714 1/20 0.34
POLB P06746 2/20 0.33
BCAT2 O15382 1/20 0.32
BCAT1 P54687 1/20 0.32
PGR P06401 1/20 0.32
IMPDH2 P12268 1/20 0.31
IMPDH1 P20839 1/20 0.31
HPGD P15428 1/20 0.31

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
SCHEMBL9711013 0.82 AR (0.37) ARESR1ESR2MEN1KMT2A
SCHEMBL9710712 0.79 PTGDR2 (0.39) KMT2AGAASMN1; SMN2IMPDH2APEX1
SCHEMBL9711023 0.78 CYP2D6 (0.33) ARGAASMN1; SMN2NPSR1IMPDH2
SCHEMBL9313692 0.77 HSD17B1 (0.36) ARESR1ESR2MEN1KMT2A
SCHEMBL9710756 0.77 F9 (0.41) ARGAAMAPTSMN1; SMN2NPSR1
SCHEMBL27579557 0.77 AR (0.42) ARESR1ESR2MEN1KMT2A
SCHEMBL9710658 0.73 AR (0.42) ARESR1ESR2MEN1KMT2A
SCHEMBL9314085 0.72 ESR1 (0.37) ESR1ESR2MEN1KMT2AGAA
SCHEMBL19280732 0.72 AR (0.52) ARSMN1; SMN2IMPDH2IMPDH1HPGD
SCHEMBL9710755 0.67 CYP11B1 (0.49) ARESR1ESR2MEN1KMT2A

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