SCHEMBL7073191

SCHEMBL7073191

COC(=O)CCc1cc(Cl)ccc1C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
TSHR P16473 1/20 0.46
CASP1 P29466 1/20 0.46
KDM4E B2RXH2 5/20 0.46
ALDH1A1 P00352 4/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
EGFR P00533 1/20 0.45
ABL1 P00519 1/20 0.43
PKM P14618 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
TP53 P04637 1/20 0.42
GRIK1 P39086 2/20 0.42
FLT1 P17948 1/20 0.42
FLT4 P35916 1/20 0.42
KDR P35968 1/20 0.42
HSD17B10 Q99714 1/20 0.42
RAB9A P51151 1/20 0.42
MRGPRX4 Q96LA9 1/20 0.42

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
SCHEMBL5499901 0.88 ABL1 (0.54) MAPTSMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL14609800 0.83 MAPT (0.54) MAPTKDM4EALDH1A1MEN1KMT2A
SCHEMBL5500307 0.82 SMN1; SMN2 (0.53) SMN1; SMN2TSHRCASP1KDM4EALDH1A1
SCHEMBL3136286 0.81 MEN1 (0.50) MAPTSMN1; SMN2CASP1MEN1KMT2A
SCHEMBL15071460 0.81 MAPT (0.49) MAPTKDM4EALDH1A1MEN1KMT2A
SCHEMBL4608717 0.80 MAPT (0.48) MAPTKDM4EALDH1A1MEN1KMT2A
SCHEMBL4609201 0.80 MAPT (0.48) MAPTKDM4EALDH1A1MEN1KMT2A
SCHEMBL11532393 0.80 MAPT (0.57) MAPTALDH1A1EGFR
SCHEMBL6057229 0.79 FLT1 (0.57) SMN1; SMN2TSHRCASP1KDM4EALDH1A1
SCHEMBL5458601 0.79 ABL1 (0.54) KDM4EALDH1A1ABL1NPSR1FLT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1105367-B1 SUBSTITUTED CINNAMIC ACIDS AND CINNAMIC ACID ESTERS BAYER AG (DE) 2003-06-18 EP disclosed
US-6455725-B1 Substituted cinnamic acids and cinnamic acid esters BAYER AKTIENGESELLSCHAFT (DE) 2002-09-24 US disclosed
EP-1105367-A1 SUBSTITUTED CINNAMIC ACIDS AND CINNAMIC ACID ESTERS Bayer Aktiengesellschaft (DE) 2001-06-13 EP disclosed
WO-2000010963-A1 SUBSTITUTED CINNAMIC ACIDS AND CINNAMIC ACID ESTERS BAYER AKTIENGESELLSCHAFT (DE) 2000-03-02 WO disclosed