SCHEMBL7634085

SCHEMBL7634085

CCOC(=O)c1cc(=O)c2cccc(C=Cc3ccc4c(c3)CC(COCc3ccc(F)cc3)O4)c2o1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.40
PRKDC P78527 1/20 0.38
GPR35 Q9HC97 1/20 0.34
AKR1B1 P15121 1/20 0.34
MAOB P27338 2/20 0.32
TP53 P04637 2/20 0.32
THRB P10828 1/20 0.32
CYSLTR2 Q9NS75 1/20 0.31
CYSLTR1 Q9Y271 1/20 0.31
LMNA P02545 3/20 0.31
MAPT P10636 2/20 0.31
PTPN1 P18031 2/20 0.31
MEN1 O00255 2/20 0.31
ATM Q13315 1/20 0.31
ALDH1A1 P00352 2/20 0.30
KDM4E B2RXH2 2/20 0.30
SMN1; SMN2 Q16637 2/20 0.30
NPC1 O15118 1/20 0.30
POLB P06746 1/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL7634078 1.00 KMT2A (0.40) KMT2APRKDCGPR35AKR1B1MAOB
SCHEMBL7634359 0.90 PRKDC (0.41) KMT2APRKDCGPR35CYSLTR2CYSLTR1
SCHEMBL7634364 0.90 PRKDC (0.41) KMT2APRKDCGPR35CYSLTR2CYSLTR1
SCHEMBL7626681 0.90 PRKDC (0.40) KMT2APRKDCLMNAKDM4EHPGD
SCHEMBL7626670 0.90 PRKDC (0.40) KMT2APRKDCLMNAKDM4EHPGD
SCHEMBL7636912 0.85 PRKDC (0.39) KMT2APRKDCLMNAPTPN1KDM4E
SCHEMBL7630341 0.84 PRKDC (0.41) KMT2APRKDCLMNA
SCHEMBL7630340 0.84 PRKDC (0.41) KMT2APRKDCLMNA
SCHEMBL7630922 0.82 GPR35 (0.49) KMT2AGPR35TP53THRBLMNA
SCHEMBL7633117 0.80 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 2 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 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