SCHEMBL6577877

SCHEMBL6577877

O=C(Cc1cccc(Cl)c1)Nc1cccc(C(=O)CO)c1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.60
MEN1 O00255 3/20 0.60
ALDH1A1 P00352 3/20 0.60
KCNQ2 O43526 4/20 0.58
MAPT P10636 2/20 0.56
KDM4E B2RXH2 1/20 0.56
NLRP3 Q96P20 1/20 0.51
KCNJ5 P48544 1/20 0.51
KCNJ3 P48549 1/20 0.51
P2RY14 Q15391 1/20 0.51
ANO1 Q5XXA6 1/20 0.50
ROCK2 O75116 1/20 0.49
HPGD P15428 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
MAPK8 P45983 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C19 P33261 1/20 0.48

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
SCHEMBL6577323 0.88 NLRP3 (0.67) KMT2AMEN1ALDH1A1MAPTKDM4E
SCHEMBL6580505 0.86 KMT2A (0.69) KMT2AMEN1ALDH1A1MAPTKDM4E
SCHEMBL29200420 0.83 MEN1 (0.66) KMT2AMEN1ALDH1A1KCNQ2MAPT
SCHEMBL30802696 0.83 MEN1 (0.66) KMT2AMEN1ALDH1A1KCNQ2MAPT
SCHEMBL28019942 0.83 ALDH1A1 (0.62) KMT2AMEN1ALDH1A1KCNQ2MAPT
SCHEMBL7237004 0.83 KDM4E (0.62) KMT2AMEN1ALDH1A1KCNQ2MAPT
SCHEMBL29200413 0.81 MEN1 (0.66) KMT2AMEN1ALDH1A1KCNQ2MAPT
SCHEMBL30802681 0.81 MEN1 (0.66) KMT2AMEN1ALDH1A1KCNQ2MAPT
SCHEMBL6579406 0.79 KCNJ5 (0.69) KMT2AALDH1A1MAPTKCNJ5KCNJ3
SCHEMBL11531211 0.79 KMT2A (0.76) KMT2AMEN1ALDH1A1MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0716088-B1 PROCESS FOR PRODUCING 2-(TETRAZOL-5-YL)-4-OXO-4H-BENZOPYRANS SUMITOMO CHEMICAL CO (JP) 2004-02-18 EP disclosed
US-5597929-A Production process of 2-(tetrazol-5-yl)-4-oxo-4H-benzopyran SUMITOMO CHEMICAL CO., LTD. (JP) 1997-01-28 US disclosed
EP-0716088-A1 PROCESS FOR PRODUCING 2-(TETRAZOL-5-YL)-4-OXO-4H-BENZOPYRANS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-06-12 EP disclosed