SCHEMBL8987241

SCHEMBL8987241

O=c1cc(-c2ccc(Cl)cc2)cc(-c2ccc(Cl)cc2)[nH]1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.55
ALDH1A1 P00352 5/20 0.55
MAPT P10636 2/20 0.55
GAA P10253 2/20 0.55
THRB P10828 1/20 0.55
TSHR P16473 1/20 0.55
KMT2A Q03164 4/20 0.49
PDE10A Q9Y233 2/20 0.49
MAPK1 P28482 1/20 0.46
MEN1 O00255 3/20 0.46
HPGD P15428 2/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
CASP3 P42574 1/20 0.46
SENP8 Q96LD8 1/20 0.46
SENP7 Q9BQF6 1/20 0.46
SENP6 Q9GZR1 1/20 0.46

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
SCHEMBL8987311 0.93 CYP1A2 (0.52) KDM4EALDH1A1MAPTGAATHRB
SCHEMBL8987106 0.93 CYP1A2 (0.52) KDM4EALDH1A1MAPTGAATHRB
SCHEMBL8987371 0.87 ALDH1A1 (0.57) KDM4EALDH1A1MAPTGAATHRB
SCHEMBL8987170 0.87 ALDH1A1 (0.57) KDM4EALDH1A1MAPTGAATHRB
SCHEMBL3562651 0.81 KDM4E (0.52) KDM4EALDH1A1MAPTGAATHRB
SCHEMBL6756097 0.79 TAS2R38 (0.60) KDM4EALDH1A1MAPTGAAMAPK1
SCHEMBL3565888 0.78 MAPK1 (0.53) KDM4EALDH1A1MAPTGAATHRB
SCHEMBL11733408 0.77 TAS2R38 (0.68) KDM4EALDH1A1MAPTGAATHRB
SCHEMBL3558874 0.77 KDM4E (0.50) KDM4EALDH1A1MAPTGAATHRB
SCHEMBL8986949 0.77 NOTUM (0.50) KDM4EALDH1A1MAPTGAAKMT2A

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-5492915-A ANTIINFLAMMATORY AGENTS RHONE-POULENC RORER S.A. (FR) 1996-02-20 US disclosed
US-5366982-A Antiinflammatory agents or antihistamines RHONE-POULENC RORER S.A. (FR) 1994-11-22 US disclosed
EP-0540604-A1 SUBSTITUTED BICYCLIC BIS-ARYL COMPOUNDS EXHIBITING SELECTIVE LEUKOTRIENE B 4? ANTAGONIST ACTIVITY, THEIR PREPARATION AND USE IN PHARMACEUTICAL COMPOSITIONS Aventis Pharma S.A. (FR) 1993-05-12 EP disclosed
WO-1992001675-A2 SUBSTITUTED BICYCLIC BIS-ARYL COMPOUNDS EXHIBITING SELECTIVE LEUKOTRIENE B4 ANTAGONIST ACTIVITY, THEIR PREPARATION AND USE IN PHARMACEUTICAL COMPOSITIONS RHONE-POULENC RORER S.A. (FR) 1992-02-06 WO disclosed