SCHEMBL9516005

SCHEMBL9516005

O=C(O)c1cc(Cl)c2cc(C(=O)O)ccc2c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.59
TTR P02766 6/20 0.50
GRIN2D O15399 1/20 0.49
GRIN2A Q12879 1/20 0.49
GRIN2C Q14957 1/20 0.49
PTPN1 P18031 1/20 0.49
SRD5A2 P31213 1/20 0.47
KDM4E B2RXH2 3/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
ALDH1A1 P00352 3/20 0.44
MAPT P10636 1/20 0.44
ALOX15 P16050 1/20 0.43
TPMT P51580 1/20 0.43
PRMT1 Q99873 1/20 0.42
HPGD P15428 2/20 0.42
THRB P10828 1/20 0.42
ENPP2 Q13822 1/20 0.42
HSD17B10 Q99714 1/20 0.42
PLA2G2D Q9UNK4 1/20 0.41

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
SCHEMBL1477136 0.86 TSHR (0.61) TSHRTTRPTPN1SRD5A2KDM4E
SCHEMBL31214608 0.81 TTR (0.65) TSHRTTRSRD5A2KDM4EALDH1A1
SCHEMBL7840769 0.81 MEN1 (0.52) TSHRTTRGRIN2DGRIN2AGRIN2C
SCHEMBL10081743 0.80 GRIN2D (0.66) TSHRTTRGRIN2DGRIN2AGRIN2C
SCHEMBL7088722 0.79 PTPN1 (0.64) TSHRGRIN2DGRIN2AGRIN2CPTPN1
SCHEMBL29904704 0.78 PTPN1 (0.59) TSHRGRIN2DGRIN2AGRIN2CPTPN1
SCHEMBL31401727 0.78 PTPN1 (0.59) TSHRGRIN2DGRIN2AGRIN2CPTPN1
SCHEMBL1879909 0.78 PTPN1 (0.59) TSHRGRIN2DGRIN2AGRIN2CPTPN1
SCHEMBL1880299 0.77 PTPN1 (0.58) TSHRGRIN2DGRIN2AGRIN2CPTPN1
SCHEMBL8383171 0.77 PLAU (0.50) TSHRTTRGRIN2DGRIN2AGRIN2C

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
US-4042571-A Fire-retardant polyamides from naphthalene dicarboxylic reactant and halogenated carboxylic reactant TEIJIN LIMITED (JA) 1977-08-16 US claimed
EP-0424860-B1 Wholly aromatic polyamides, process for their preparation and products therefrom HOECHST AG (DE) 1993-12-01 EP disclosed
US-5097015-A Fibers, filaments, films and sheets HOECHST AKTIENGESELLSCHAFT (DE) 1992-03-17 US disclosed
EP-0424860-A2 Wholly aromatic polyamides, process for their preparation and products therefrom HOECHST AKTIENGESELLSCHAFT (DE) 1991-05-02 EP disclosed