SCHEMBL7634359

SCHEMBL7634359

O=C(O)c1cc(=O)c2cccc(/C=C/c3ccc4c(c3)CC(COCc3ccc(F)cc3)O4)c2o1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 2/20 0.41
CYSLTR2 Q9NS75 1/20 0.36
CYSLTR1 Q9Y271 1/20 0.36
KMT2A Q03164 1/20 0.35
GPR35 Q9HC97 10/20 0.35
PDE5A O76074 1/20 0.34
KDM4E B2RXH2 1/20 0.34
HPGD P15428 1/20 0.34
LMNA P02545 1/20 0.32

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
SCHEMBL7634364 1.00 PRKDC (0.41) PRKDCCYSLTR2CYSLTR1KMT2AGPR35
SCHEMBL7626681 0.93 PRKDC (0.40) PRKDCKMT2AKDM4EHPGDLMNA
SCHEMBL7626670 0.93 PRKDC (0.40) PRKDCKMT2AKDM4EHPGDLMNA
SCHEMBL7634078 0.90 KMT2A (0.40) PRKDCCYSLTR2CYSLTR1KMT2AGPR35
SCHEMBL7634085 0.90 KMT2A (0.40) PRKDCCYSLTR2CYSLTR1KMT2AGPR35
SCHEMBL7636912 0.90 PRKDC (0.39) PRKDCKMT2AKDM4EHPGDLMNA
SCHEMBL7630341 0.88 PRKDC (0.41) PRKDCKMT2ALMNA
SCHEMBL7630340 0.88 PRKDC (0.41) PRKDCKMT2ALMNA
SCHEMBL7633114 0.83 PRKDC (0.37) PRKDCLMNA
SCHEMBL7633117 0.83 PRKDC (0.37) PRKDCLMNA

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-0888327-B1 BENZOPYRAN DERIVATIVES HAVING LEUKOTRIENE-ANTAGONISTIC ACTION MENARINI LAB (ES) 2002-06-12 EP claimed
EP-0888327-B1 BENZOPYRAN DERIVATIVES HAVING LEUKOTRIENE-ANTAGONISTIC ACTION MENARINI LAB (ES) 2002-06-12 EP disclosed
US-5990142-A ANTIINFLAMMATORY AGENTS AND ANTIALLERGENS HAVING GOOD ORAL ADSORPTION AND BIOAVAILABILITY; CARDIOTONIC AND ANTIISCHEMIC AGENTS LABORATORIOS MENARINI S.A. (ES) 1999-11-23 US disclosed