SCHEMBL8640667

SCHEMBL8640667

O=C1C=CC(C=Cc2ccccc2)=CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
RAB9A P51151 2/20 0.38
PKM P14618 1/20 0.38
CMA1 P23946 1/20 0.38
TRPA1 O75762 2/20 0.37
MAOB P27338 2/20 0.37
LMNA P02545 4/20 0.36
ALDH1A1 P00352 2/20 0.36
NFE2L2 Q16236 1/20 0.36
CYP19A1 P11511 1/20 0.36
MAOA P21397 1/20 0.36
ALOX5 P09917 1/20 0.36
MAPK1 P28482 1/20 0.36
CYP1A2 P05177 2/20 0.35
MAPT P10636 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
HDAC3 O15379 1/20 0.35
TNKS O95271 1/20 0.35

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
SCHEMBL11331308 0.85 CMA1 (0.33) RECQLSMN1; SMN2RAB9APKMCMA1
SCHEMBL7905018 0.84 GSK3A (0.36)
SCHEMBL11615801 0.79 RELA (0.39) TRPA1MAOBNFE2L2CYP19A1MAOA
SCHEMBL4596796 0.72 HCAR2 (0.36) PKMLMNAALDH1A1ALOX5MAPK1
SCHEMBL25057557 0.69 MAOB (0.39) TRPA1MAOBLMNAALDH1A1NFE2L2
SCHEMBL2030189 0.69
SCHEMBL4438933 0.69 MAOB (0.39) CMA1TRPA1MAOBNFE2L2CYP19A1
SCHEMBL4065553 0.68 CFTR (0.37) SMN1; SMN2RAB9AMAOBLMNAALDH1A1
(Z)-1,2-Diphenylethene SCHEMBL272984 0.68 MAOB (0.52) RECQLSMN1; SMN2CMA1TRPA1MAOB
Hydrochloric Acid SCHEMBL12003783 0.68 MAOB (0.38) CMA1TRPA1MAOBNFE2L2CYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101365696-A Compounds and compositions as modulators of steroid hormone nuclear receptors IRM LLC (BM) 2009-02-11 CN disclosed
EP-0664014-B1 NLO SIDE CHAIN POLYMERS HAVING LOW OPTICAL LOSS AKZO NOBEL NV (NL) 1998-08-19 EP disclosed
EP-0664014-A1 NLO SIDE CHAIN POLYMERS HAVING LOW OPTICAL LOSS Akzo Nobel N.V. (NL) 1995-07-26 EP disclosed
EP-0445864-B1 Thermally curable NLO system and integrated optical components prepared therefrom AKZO NOBEL NV (NL) 1994-08-24 EP disclosed
WO-1994008269-A1 NLO SIDE CHAIN POLYMERS HAVING LOW OPTICAL LOSS AKZO NOBEL N.V. (NL) 1994-04-14 WO disclosed
EP-0445864-A1 Thermally curable NLO system and integrated optical components prepared therefrom Akzo Nobel N.V. (NL) 1991-09-11 EP disclosed