SCHEMBL1997257

SCHEMBL1997257

Oc1cccc2[nH]nc(-c3ccccc3)c12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTK P33981 6/20 0.56
KDM4E B2RXH2 3/20 0.56
ALDH1A1 P00352 3/20 0.56
MAPK10 P53779 3/20 0.56
ALPL P05186 1/20 0.56
GAA P10253 1/20 0.56
IDO1 P14902 1/20 0.56
HPGD P15428 1/20 0.56
MAP2K4 P45985 8/20 0.55
MAPK1 P28482 3/20 0.55
MAPK6 Q16659 2/20 0.55
MAPKAPK2 P49137 1/20 0.55
NPC1 O15118 2/20 0.49
TP53 P04637 1/20 0.49
RAB9A P51151 1/20 0.49
MAPKAPK3 Q16644 1/20 0.45
CDK2 P24941 3/20 0.44
MAPK9 P45984 3/20 0.44
PRKD3 O94806 2/20 0.44
MAP4K4 O95819 2/20 0.44

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
SCHEMBL5078605 0.85 MAP2K4 (0.55) TTKKDM4EALDH1A1MAPK10ALPL
SCHEMBL19632938 0.82 MAP2K4 (0.52) TTKIDO1HPGDMAP2K4MAPK1
SCHEMBL3020582 0.79 TTK (0.56) TTKKDM4EALDH1A1MAPK10ALPL
SCHEMBL27968541 0.79 TTK (0.56) TTKKDM4EALDH1A1MAPK10ALPL
SCHEMBL3661465 0.79 TTK (0.56) TTKKDM4EALDH1A1MAPK10ALPL
SCHEMBL5971620 0.78 ALDH1A1 (0.56) TTKKDM4EALDH1A1MAPK10ALPL
SCHEMBL2203806 0.77 NPSR1 (0.65) TTKKDM4EALDH1A1MAPK10ALPL
SCHEMBL3802281 0.75 IMPDH2 (0.44) TTKKDM4EALDH1A1MAPK10GAA
SCHEMBL8830035 0.75 TTK (0.51) TTKKDM4EALDH1A1MAPK10ALPL
SCHEMBL3539308 0.74 FGFR1 (0.61) KDM4EALDH1A1GAANPC1TP53

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 41 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-61159421-A None JP disclosed
JP-61159420-A None JP disclosed
EP-1765752-B1 METHOD FOR SEPARATING PHENOL FROM STREAMS CONTAINING PHENOL THAT HAVE BEEN OBTAINED DURING THE PRODUCTION OF BISPHENOL A BAYER IP GMBH (DE) 2015-08-26 EP disclosed
EP-1242349-B1 BIS(4-HYDROXYARYL)ALKANES BAYER MATERIALSCIENCE AG (DE) 2013-02-20 EP disclosed
EP-1944284-B1 Crystallisation method for creating bisphenol A BAYER MATERIALSCIENCE AG (DE) 2011-06-29 EP disclosed
EP-1268379-B9 METHOD FOR PRODUCING BISPHENOLS BAYER MATERIALSCIENCE AG (DE) 2010-02-24 EP disclosed
EP-1728777-B1 Process for the preparation of 2,2-bis(4-hydroxyphenyl)propane (Bisphenol A) BAYER MATERIALSCIENCE AG (DE) 2009-09-16 EP disclosed
US-7586012-B2 Process for recovering an adduct of a bis(4-hydroxyaryl)alkane and a phenolic compound DOW GLOBAL TECHNOLOGIES INC. 2009-09-08 US disclosed
EP-1268379-B2 METHOD FOR PRODUCING BISPHENOLS BAYER MATERIALSCIENCE AG (DE) 2009-06-17 EP disclosed
EP-1992604-A2 Method for producing bisphenol A with increased crystallisation duration Bayer MaterialScience AG (DE) 2008-11-19 EP disclosed
EP-1242350-A1 BISPHENOL PHENOL ADDUCTS BAYER AG (DE) 2002-09-25 EP disclosed
EP-1240232-A1 METHOD FOR PRODUCING POLYCARBONATE Bayer Aktiengesellschaft (DE) 2002-09-18 EP disclosed
WO-2001074750-A1 SUBSTANCE MIXTURE CONTAINING BISPHENOL A BAYER AKTIENGESELLSCHAFT (DE) 2001-10-11 WO disclosed
WO-2001072677-A1 METHOD FOR PRODUCING BISPHENOLS BAYER AKTIENGESELLSCHAFT (DE) 2001-10-04 WO disclosed
WO-2001047851-A1 FLUIDISED BISPHENOL DUST BAYER AKTIENGESELLSCHAFT (DE) 2001-07-05 WO disclosed
WO-2001046105-A1 BISPHENOL PHENOL ADDUCTS BAYER AKTIENGESELLSCHAFT (DE) 2001-06-28 WO disclosed
WO-2001036511-A1 METHOD FOR PRODUCING POLYCARBONATE BAYER AKTIENGESELLSCHAFT (DE) 2001-05-25 WO disclosed
US-5675004-A POLYMER STABILIZERS TO PROTECT AGAINST ACTINIC RADIATION COVERING MORE OF THE NEAR-UV SPECTRUM; DISCOLORATION INHIBITION; SYNERGISTIC EFFECT WITH HINDERED AMINES; ALKYD, ACRYLIC, URETHANE COATINGS CIBA-GEIGY CORPORATION (US) 1997-10-07 US disclosed
JP-S61159420-A AROMATIC POLYETHER COPOLYMER MITSUI TOATSU CHEM INC 1986-07-19 JP disclosed
JP-S61159421-A AROMATIC POLYETHER POLYMER MITSUI TOATSU CHEM INC 1986-07-19 JP disclosed