SCHEMBL5745989

SCHEMBL5745989

CCc1c[c]c2cc3ccccc3cc2c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.52
CYP2A6 P11509 1/20 0.52
TP53 P04637 1/20 0.37
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
HTR2B P41595 1/20 0.33
HTR6 P50406 1/20 0.32
SIGMAR1 Q99720 1/20 0.32
RIOK2 Q9BVS4 1/20 0.31
ALDH1A1 P00352 3/20 0.31
MAPT P10636 3/20 0.31
GLA P06280 2/20 0.31
HPGD P15428 2/20 0.31
ACHE P22303 1/20 0.31
RAB9A P51151 3/20 0.31
NPC1 O15118 2/20 0.31
LMNA P02545 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31

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
SCHEMBL457224 0.85 CYP1A2 (0.50) CYP1A2CYP2A6TP53HTR2AHTR2C
SCHEMBL2254075 0.83 BCHE (0.40) CYP1A2CYP2A6SIGMAR1ALDH1A1NPC1
SCHEMBL27561466 0.81 HTR2A (0.41) CYP1A2CYP2A6HTR2AHTR2CHTR2B
SCHEMBL2253148 0.80 BCHE (0.39) TP53HTR2AHTR2CALDH1A1MAPT
SCHEMBL5750005 0.80 BCHE (0.39) TP53HTR2AHTR2CALDH1A1MAPT
SCHEMBL2251715 0.80 BCHE (0.39) TP53HTR2AHTR2CALDH1A1MAPT
SCHEMBL2256663 0.75 GAA (0.41) TP53ALDH1A1MAPTRAB9ANPC1
SCHEMBL2698723 0.75 CYP2A6 (0.46) CYP1A2CYP2A6ALDH1A1MAPTGLA
SCHEMBL5747766 0.74 CYP1A2 (0.56) CYP1A2CYP2A6HTR2AHTR2CHTR2B
SCHEMBL5749886 0.74 CYP1A2 (0.56) CYP1A2CYP2A6HTR2AHTR2CHTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1762957-B 2,3-dihydro-1-indene compound and preparation method thereof BASELL POLYOLEFINE GMBH 2010-05-12 CN disclosed
CN-100451024-C Metallocene compound, indene compound and application thereof BASELL POLYOLEFINE GMBH (DE) 2009-01-14 CN disclosed
US-20060293503-A1 Polyaminopyridines and method for producing same SUMITOMO SEIKA CHEMICALS CO., LTD (JP) 2006-12-28 US disclosed
CN-1261501-C Adhesive ethylene copolymer resin composition and laminated material containing the same MITSUI CHEMICALS INC (JP) 2006-06-28 CN disclosed
EP-1669390-A1 POLYAMINOPYRIDINES AND METHOD FOR PRODUCING SAME SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 2006-06-14 EP disclosed
CN-1762957-A 2,3-dihydro-1-indene compound and preparation method thereof BASELL POLYOLEFINE GMBH (DE) 2006-04-26 CN disclosed
CN-1763060-A Metallocene compound, indene compound and application thereof BASELL POLYOLEFINE GMBH (DE) 2006-04-26 CN disclosed
CN-1239659-C Bonded copolyvinyls resin compsn and laminate contg same MITSUI CHEMICALS INC (JP) 2006-02-01 CN disclosed
CN-1231431-C Process for preparing substituted 2, 3-dihydro-1-indanones TARGOR GMBH (DE) 2005-12-14 CN disclosed
CN-1526761-A Adhesive ethylene copolymer resin composition and laminated material containing the same ������ѧ��ʽ���� 2004-09-08 CN disclosed
CN-1163542-C Adhesive ethylene copolymer resin composition and laminate using the same ������ѧ��ʽ���� 2004-08-25 CN disclosed
CN-1519290-A Bonded copolyvinyls resin compsn and laminate contg same ������ѧ��ʽ���� 2004-08-11 CN disclosed
CN-1102610-C Adhesive ethylene copolymer resin composition and laminate using the same MITSUI PETROCHEMICAL IND (JP) 2003-03-05 CN disclosed
CN-1304969-A Adhesive ethylene copolymer resin composition and laminate using the same MITSUI CHEMICALS INC (JP) 2001-07-25 CN disclosed
CN-1065541-C Method of treating polyolefin MITSUI PETROCHEMICAL IND (JP) 2001-05-09 CN disclosed
CN-1254328-A Process for preparing substituted 2, 3-dihydro-1-indanones TARGOR GMBH (DE) 2000-05-24 CN disclosed
CN-1170729-A Method of treating polyolefin MITSUI PETROCHEMICAL IND (JP) 1998-01-21 CN disclosed
CN-1165531-A Adhesive ethylene copolymer resin composition and laminate using the same MITSUI PETROCHEMICAL IND (JP) 1997-11-19 CN disclosed