SCHEMBL9215178

SCHEMBL9215178

COC(=O)/C(Br)=C(/OC)c1cccc2ccc(COc3ccccc3)cc12

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 2/20 0.43
MRGPRX4 Q96LA9 2/20 0.41
FFAR1 O14842 1/20 0.40
MAOB P27338 2/20 0.40
RAB9A P51151 2/20 0.39
NPC1 O15118 1/20 0.39
TP53 P04637 1/20 0.39
PKM P14618 1/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
MTNR1A P48039 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
SCHEMBL8948931 0.92 MRGPRX4 (0.42) HIF1AMRGPRX4FFAR1MAOBRAB9A
SCHEMBL8948927 0.92 MRGPRX4 (0.42) HIF1AMRGPRX4FFAR1MAOBRAB9A
SCHEMBL9223392 0.78 MEN1 (0.44) HIF1AFFAR1SMN1; SMN2RXFP1
SCHEMBL8948955 0.78 MTNR1A (0.40) MTNR1A
SCHEMBL8948952 0.78 MTNR1A (0.40) MTNR1A
SCHEMBL8948942 0.77 MRGPRX4 (0.43) MRGPRX4FFAR1MAOBRAB9ANPC1
SCHEMBL8948936 0.77 MRGPRX4 (0.43) MRGPRX4FFAR1MAOBRAB9ANPC1
SCHEMBL8948946 0.77 MRGPRX4 (0.43) MRGPRX4FFAR1MAOBRAB9ANPC1
SCHEMBL9222166 0.76 MRGPRX4 (0.42) MRGPRX4FFAR1MAOBRAB9ANPC1
SCHEMBL9213563 0.76 MRGPRX4 (0.42) MRGPRX4FFAR1MAOBRAB9ANPC1

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
EP-0525516-B1 Derivatives of beta substituted cinnomic acid BASF AG (DE) 1995-09-27 EP disclosed
EP-0525516-A2 Derivatives of beta substituted cinnomic acid BASF Aktiengesellschaft (DE) 1993-02-03 EP disclosed