SCHEMBL7269663

SCHEMBL7269663

CCC1=C(c2cccc3ccccc23)c2ccccc2[CH]1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.37
ALDH1A1 P00352 4/20 0.35
POLB P06746 2/20 0.35
LMNA P02545 1/20 0.35
GAA P10253 1/20 0.35
KDM4E B2RXH2 1/20 0.35
CYP3A4 P08684 1/20 0.34
HPGD P15428 1/20 0.34
TSHR P16473 1/20 0.34
KEAP1 Q14145 1/20 0.34
HSD17B10 Q99714 1/20 0.34
CYP2A6 P11509 1/20 0.34
CHRNB4 P30926 1/20 0.34
CHRNA3 P32297 1/20 0.34
CHRNA7 P36544 1/20 0.34
HTR2C P28335 2/20 0.33
PPARG P37231 2/20 0.33
PPARA Q07869 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
SETD7 Q8WTS6 1/20 0.33

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
SCHEMBL7262248 0.88 ALDH1A1 (0.35) TDP1ALDH1A1POLBLMNAGAA
SCHEMBL7262259 0.87 TDP1 (0.36) TDP1ALDH1A1POLBLMNAGAA
SCHEMBL7268103 0.86 CYP1A2 (0.33) ALDH1A1GAAKDM4EHPGDTSHR
SCHEMBL4622627 0.82 CYP1A2 (0.34) TDP1ALDH1A1KDM4EHPGDDHFR
SCHEMBL714807 0.77 ALDH1A1 (0.42) TDP1ALDH1A1POLBGAAKDM4E
SCHEMBL5691392 0.76 KDM4E (0.35) TDP1ALDH1A1POLBGAAKDM4E
SCHEMBL5689082 0.76 KDM4E (0.38) TDP1ALDH1A1POLBKDM4EHPGD
SCHEMBL7262293 0.76 ALDH1A1 (0.33) TDP1ALDH1A1POLBGAAKDM4E
SCHEMBL28025480 0.75 TP53 (0.38) ALDH1A1LMNAHPGDTSHRHSD17B10
SCHEMBL7268116 0.74 MEN1 (0.31) ALDH1A1GAAKDM4ESETD7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6114556-A Metallocene compound and its use as catalyst component TARGOR GMBH (DE) 2000-09-05 US claimed
US-6656601-B1 Adhesive ethylene copolymer resin compositions and laminates using the same MITSUI CHEMICALS INC. (JP) 2003-12-02 US disclosed
EP-1219657-A1 POLYARYLENE AND METHOD FOR PRODUCTION THEREOF Japan Science and Technology Corporation (JP) 2002-07-03 EP disclosed
EP-0791628-B1 ADHESIVE ETHYLENIC POLYMER RESIN COMPOSITION AND LAMINATE PRODUCED FROM THE COMPOSITION MITSUI CHEMICALS INC (JP) 2001-11-21 EP disclosed
US-6183863-B1 ETHYLENE-ALPHA-OLEFIN GRAFT COPOLYMER AND POLYMERIZATION CATALYSTS FOR ADHESIVE LAMINATES MITSUI CHEMICAL INC (JP) 2001-02-06 US disclosed
US-6114556-A Metallocene compound and its use as catalyst component TARGOR GMBH (DE) 2000-09-05 US disclosed
US-5962359-A Metallocene compound and its use as catalyst component TARGOR GMBH (DE) 1999-10-05 US disclosed
EP-0791628-A1 ADHESIVE ETHYLENIC POLYMER RESIN COMPOSITION AND LAMINATE PRODUCED FROM THE COMPOSITION MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1997-08-27 EP disclosed
EP-0723971-A2 Metallocenes and their use as catalyst component HOECHST AKTIENGESELLSCHAFT (DE) 1996-07-31 EP disclosed