SCHEMBL6691636

SCHEMBL6691636

CC(=O)Nc1cc(NC(C)=O)c2ccccc2c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.57
KLK7 P49862 1/20 0.54
CASP6 P55212 1/20 0.54
HSD17B10 Q99714 2/20 0.50
NAPRT Q6XQN6 1/20 0.50
KDM4E B2RXH2 5/20 0.48
ALDH1A1 P00352 4/20 0.48
GLA P06280 1/20 0.48
GAA P10253 1/20 0.48
RXFP1 Q9HBX9 1/20 0.47
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
APAF1 O14727 1/20 0.47
SENP7 Q9BQF6 1/20 0.47
SENP6 Q9GZR1 1/20 0.47
HPGD P15428 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
LMNA P02545 1/20 0.46
CYP1A2 P05177 1/20 0.46
MAOA P21397 1/20 0.46

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
SCHEMBL9464673 0.83 CDC25B (0.55) POLBCASP6HSD17B10KDM4EALDH1A1
SCHEMBL6746219 0.82 ALDH1A1 (0.59) POLBCASP6HSD17B10KDM4EALDH1A1
SCHEMBL14503713 0.81 POLB (0.49) POLBCASP6HSD17B10KDM4EALDH1A1
SCHEMBL1176646 0.81 ESRRA (0.57) POLBKLK7HSD17B10NAPRTKDM4E
SCHEMBL17442371 0.81 KLK7 (0.53) POLBKLK7HSD17B10NAPRTKDM4E
SCHEMBL11900180 0.81 CASP6 (0.68) POLBKLK7CASP6HSD17B10KDM4E
SCHEMBL8018981 0.81 CASP6 (0.72) POLBCASP6HSD17B10KDM4EALDH1A1
SCHEMBL6746166 0.79 MAPT (0.62) POLBKDM4EALDH1A1GLAGAA
SCHEMBL11900068 0.79 KMT2A (0.54) POLBKDM4EALDH1A1GAAKMT2A
SCHEMBL357522 0.78 KDM4E (0.69) POLBCASP6KDM4EALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8377530-B2 Polyesters with low molecular weight additives for improved gas barrier properties EASTMAN CHEMICAL COMPANY (US) 2013-02-19 US disclosed
US-20120199515-A1 POLYESTERS WITH LOW MOLECULAR WEIGHT ADDITIVES FOR IMPROVED GAS BARRIER PROPERTIES EASTMAN CHEMICAL COMPANY (US) 2012-08-09 US disclosed
EP-0950669-B1 Method of catalytic crosslinking of polymers and two-pack composition used therein ROHM & HAAS (US) 2004-09-08 EP disclosed
EP-0713148-B1 Naphthylenediamine derivative and electrophotosensitive material using the same KYOCERA MITA CORP (JP) 2002-03-13 EP disclosed
US-6306991-B1 TWO PART COATING COMPOSITION WITH TWO CONTAINERS, OXIDATIVE POLYMERS WITH CROSSLINKABLE FUNCTIONAL GROUPS ROHM AND HAAS COMPANY 2001-10-23 US disclosed
US-6149977-A CONTACTING THE OXIDATIVE POLYMER WITH A CATALYTIC AMOUNT OF AN OXIDIZING ENZYME, SUCH AS HORSERADISH PEROXIDASE. ROHM AND HAAS COMPANY (US) 2000-11-21 US disclosed
EP-0950669-A2 Method of catalytic crosslinking of polymers and two-pack composition used therein ROHM AND HAAS COMPANY (US) 1999-10-20 EP disclosed
US-5830615-A ELECTRIC CHARGE TRANSFERRING CAPABILITY, COMPATIBILITY, DURABILITY MITA INDUSTRIAL CO., LTD. (JP) 1998-11-03 US disclosed
US-5767315-A CHARGE TRANSFER COMPOUNDS MITA INDUSTRIAL CO., LTD. (JP) 1998-06-16 US disclosed
EP-0713148-A1 Naphthylenediamine derivative and electrophotosensitive material using the same MITA INDUSTRIAL CO. LTD. (JP) 1996-05-22 EP disclosed