SCHEMBL6577874

SCHEMBL6577874

CC(=O)c1cc(NC(=O)Cc2cccc(Cl)c2)ccc1O

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.61
▸ KMT2A Q03164 2/20 0.61
▸ ALDH1A1 P00352 1/20 0.61
▸ KDM4E B2RXH2 1/20 0.54
▸ KCNQ2 O43526 3/20 0.54
▸ PIK3CA P42336 1/20 0.53
▸ P2RX4 Q99571 2/20 0.51
▸ P2RX1 P51575 1/20 0.51
▸ P2RX7 Q99572 1/20 0.51
▸ MAPT P10636 2/20 0.51
▸ ANO1 Q5XXA6 2/20 0.51
▸ CSNK1D P48730 1/20 0.51
▸ ROCK2 O75116 1/20 0.50
▸ MAPK8 P45983 1/20 0.49
▸ NLRP3 Q96P20 1/20 0.49
▸ MAOA P21397 1/20 0.48
▸ MAOB P27338 1/20 0.48
▸ FADS1 O60427 2/20 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
SCHEMBL6577319 0.86 NLRP3 (0.59) MEN1KMT2AALDH1A1KDM4EP2RX1
SCHEMBL6580500 0.85 EPHX2 (0.57) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL6579400 0.79 KCNJ5 (0.60) MEN1KMT2AALDH1A1KDM4EP2RX4
SCHEMBL6581781 0.79 KCNQ2 (0.60) MEN1KMT2AALDH1A1KDM4EKCNQ2
SCHEMBL13602309 0.76 KMT2A (0.64) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL6582469 0.76 ALDH1A1 (0.66) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL29200420 0.76 MEN1 (0.66) MEN1KMT2AALDH1A1KDM4EKCNQ2
SCHEMBL15650665 0.76 MEN1 (0.74) MEN1KMT2AALDH1A1KDM4EKCNQ2
SCHEMBL29200413 0.76 MEN1 (0.66) MEN1KMT2AALDH1A1KDM4EKCNQ2
SCHEMBL30802696 0.76 MEN1 (0.66) MEN1KMT2AALDH1A1KDM4EKCNQ2

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
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