SCHEMBL11269840

SCHEMBL11269840

Cc1ccc(OC(=O)c2ccc(C(=O)O)cc2)c(C(=O)O)c1

nearest known ligand 0.69

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
ALDH1A1 P00352 1/20 0.50
CSNK2A1 P68400 1/20 0.47
CFD P00746 2/20 0.46
SRD5A2 P31213 1/20 0.46

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
SCHEMBL11559171 0.90 KMT2A (0.57) KMT2ASMN1; SMN2ALDH1A1
SCHEMBL11275036 0.86 ESR1 (0.50) KMT2AALDH1A1CFD
SCHEMBL11191978 0.82 MAPT (0.56) KMT2AALDH1A1CFD
SCHEMBL20377181 0.81 CSNK2A1 (0.55) KMT2AALDH1A1CSNK2A1CFD
SCHEMBL29678114 0.81 CSNK2A1 (0.55) KMT2AALDH1A1CSNK2A1CFD
SCHEMBL7766099 0.80 WDR5 (0.47) KMT2ASMN1; SMN2ALDH1A1SRD5A2
SCHEMBL1317371 0.80 CFD (0.71) KMT2ASMN1; SMN2ALDH1A1CSNK2A1CFD
SCHEMBL1816359 0.79 ALDH1A1 (0.50) KMT2ASMN1; SMN2ALDH1A1SRD5A2
SCHEMBL1323563 0.79 KDM4E (0.61) KMT2ASMN1; SMN2ALDH1A1
SCHEMBL21771870 0.78 KMT2A (0.51) KMT2A

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-0052927-A2 Stretched film structure of the poly-1,3-phenylene terephthalate type MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1982-06-02 EP disclosed