SCHEMBL7719474

SCHEMBL7719474

N#COc1ccc2ccccc2c1Cc1c(OC#N)ccc2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.47
CYP1A2 P05177 2/20 0.47
CYP2C9 P11712 2/20 0.47
CYP2C19 P33261 2/20 0.47
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
KDM4E B2RXH2 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 3/20 0.39
ALDH1A1 P00352 2/20 0.38
CYP2A6 P11509 1/20 0.38
TSHR P16473 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
NCEH1 Q6PIU2 2/20 0.38
GAA P10253 1/20 0.37
TAAR1 Q96RJ0 1/20 0.37
HPRT1 P00492 1/20 0.35
POLB P06746 1/20 0.35
CA1 P00915 1/20 0.35

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
SCHEMBL7106897 0.80 PTPN22 (0.48) HSD17B10CYP1A2CYP2C9CYP2C19KMT2A
SCHEMBL7724729 0.79 MAPT (0.57) HSD17B10CYP1A2CYP2C9CYP2C19KMT2A
SCHEMBL30337147 0.79 MAPT (0.57) HSD17B10CYP1A2CYP2C9CYP2C19KMT2A
SCHEMBL1325259 0.78 MAPT (0.41) HSD17B10CYP1A2CYP2C9CYP2C19KDM4E
SCHEMBL27498748 0.76 NCEH1 (0.49) HSD17B10CYP1A2CYP2C9CYP2C19KMT2A
SCHEMBL19766698 0.76 MAPT (0.62) HSD17B10CYP1A2CYP2C9CYP2C19KMT2A
SCHEMBL19231594 0.76 HSD17B10 (0.57) HSD17B10CYP1A2CYP2C9CYP2C19KDM4E
SCHEMBL30725930 0.75 HTR1B (0.46) HSD17B10CYP1A2CYP2C19KMT2AMEN1
SCHEMBL822708 0.75 HTR1B (0.46) HSD17B10CYP1A2CYP2C19KMT2AMEN1
SCHEMBL184490 0.74 IMPDH2 (0.47) KMT2AMEN1KDM4ESMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6337375-B1 RESIN WITH COLOR AND FLUORESCING AGENT INTERNATIONAL BUSINESS MACHINES CORPORATION 2002-01-08 US disclosed
US-6190759-B1 ELECTRONIC PACKAGE COMPRISING DIELECTRIC LAYER AND CONDUCTIVE LAYER, SAID DIELECTRIC LAYER INCLUDING REINFORCING MATERIAL, RESIN MATERIAL SELECTED FROM EPOXY, CYANATE AND BISMALEIMIDE RESINS, COLORING AGENT, AND FLUORESCING AGENT INTERNATIONAL BUSINESS MACHINES CORPORATION 2001-02-20 US disclosed
US-6187417-B1 Substrate having high optical contrast and method of making same INTERNATIONAL BUSINESS MACHINES CORPORATION 2001-02-13 US disclosed
US-5605781-A Photosensitive composition with cyanate esters and use thereof INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 1997-02-25 US disclosed
US-5464726-A Making resist image by exposing positive photosensitive composition /cyanate ester and cationic photoinitiator generating Bronsted acid upon exposure to actinic light/ in predetermined pattern to actinic light, heating, developing INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 1995-11-07 US disclosed
EP-0413087-A1 Photosensitive composition and use thereof International Business Machines Corporation (US) 1991-02-20 EP disclosed
EP-0147547-B1 PREPARATION OF AROMATIC CYANATES THE DOW CHEMICAL COMPANY (US) 1989-11-15 EP disclosed
EP-0147548-B1 NOVEL POLYAROMATIC CYANATES AND POLYTRIAZINES PREPARED THEREFROM THE DOW CHEMICAL COMPANY (US) 1989-09-13 EP disclosed
EP-0180649-B1 NOVEL CATALYSTS FOR THE PRODUCTION OF POLYTRIAZINES FROM AROMATIC POLYCYANATES THE DOW CHEMICAL COMPANY (US) 1988-11-30 EP disclosed
US-4751323-A MONOMERS FOR POLYTRIAZINE, POLYCANURATES THE DOW CHEMICAL COMPANY (US) 1988-06-14 US disclosed
EP-0147548-A2 Novel polyaromatic cyanates and polytriazines prepared therefrom THE DOW CHEMICAL COMPANY (US) 1985-07-10 EP disclosed
EP-0147547-A2 Preparation of aromatic cyanates THE DOW CHEMICAL COMPANY (US) 1985-07-10 EP disclosed
US-4528366-A Production of polytriazines from aromatic polycyanates with cobalt salt of a carboxylic acid as catalyst THE DOW CHEMICAL COMPANY (US) 1985-07-09 US disclosed
WO-1985002184-A1 POLYAROMATIC CYANATES, A PROCESS FOR PREPARING THE POLYAROMATIC CYANATES, AND POLYTRIAZINES PREPARED FROM THE POLYAROMATIC CYANATES THE DOW CHEMICAL COMPANY (US) 1985-05-23 WO disclosed
WO-1985002185-A1 A PROCESS FOR THE PREPARATION OF AROMATIC CYANATES THE DOW CHEMICAL COMPANY (US) 1985-05-23 WO disclosed
US-4195132-A CROSSLINKING BY WAT OF TRIAZINE RINGS BAYER AKTIENGESELLSCHAFT (DE) 1980-03-25 US disclosed
US-4116946-A OLEFIN, CATALYST BAYER AKTIENGESELLSCHAFT (DE) 1978-09-26 US disclosed
US-4094852-A Process for the production of polytriazines in the presence of high-boiling esters BAYER AKTIENGESELLSCHAFT (DT) 1978-06-13 US disclosed
US-4066577-A HIGH MOLECULAR WEIGHT POLYTRIAZINES OF SOLUBLE POLYMERIC N-CYANO-ISOUREA ETHERS BAYER AKTIENGESELLSCHAFT (DT) 1978-01-03 US disclosed
US-4031067-A Polytriazines and a process for their production BAYER AKTIENGESELLSCHAFT (DT) 1977-06-21 US disclosed