SCHEMBL8972152

SCHEMBL8972152

CCc1ccc(C=Cc2ccc(O)cc2)nc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.54
L3MBTL1 Q9Y468 3/20 0.54
KMT2A Q03164 4/20 0.50
RAB9A P51151 3/20 0.50
PTGS2 P35354 3/20 0.46
ALOX5 P09917 2/20 0.46
PTGS1 P23219 2/20 0.46
MAPT P10636 4/20 0.44
MEN1 O00255 3/20 0.44
ALDH1A1 P00352 3/20 0.44
LMNA P02545 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
NPC1 O15118 2/20 0.44
DHFR P00374 1/20 0.43
CD74 P04233 1/20 0.42
MIF P14174 1/20 0.42
APP P05067 5/20 0.41
CA12 O43570 2/20 0.40
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40

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
SCHEMBL9148560 1.00 KDM4E (0.54) KDM4EL3MBTL1KMT2ARAB9APTGS2
SCHEMBL5651345 0.84 DHFR (0.51) KDM4EL3MBTL1KMT2ARAB9APTGS2
SCHEMBL5651348 0.84 DHFR (0.51) KDM4EL3MBTL1KMT2ARAB9APTGS2
SCHEMBL317843 0.80 MAPT (0.56) KDM4EL3MBTL1KMT2ARAB9APTGS2
SCHEMBL317844 0.80 MAPT (0.56) KDM4EL3MBTL1KMT2ARAB9APTGS2
SCHEMBL1604436 0.80 KMT2A (0.61) KDM4EL3MBTL1KMT2ARAB9APTGS2
SCHEMBL1604435 0.80 KMT2A (0.61) KDM4EL3MBTL1KMT2ARAB9APTGS2
SCHEMBL8175694 0.77 KMT2A (0.58) KDM4EL3MBTL1KMT2ARAB9APTGS2
SCHEMBL8484179 0.77 KMT2A (0.58) KDM4EL3MBTL1KMT2ARAB9APTGS2
SCHEMBL20467912 0.76 RRM2 (0.49) KDM4EL3MBTL1KMT2ARAB9APTGS2

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-0545409-B1 Liquid crystals with end groups containing more than one silane group CONSORTIUM ELEKTROCHEM IND (DE) 1996-03-06 EP disclosed
US-5399290-A Liquid crystals with (polysila) alkyl wing groups CONSORTIUM FUR ELEKTROCHEMISCHE INDUSTRIE GMBH (DE) 1995-03-21 US disclosed
EP-0545409-A1 Liquid crystals with end groups containing more than one silane group Consortium für elektrochemische Industrie GmbH (DE) 1993-06-09 EP disclosed