SCHEMBL5486071

SCHEMBL5486071

Cn1ccnc1-c1cccc2ccccc12

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 4/20 0.66
HTR2A P28223 1/20 0.66
BRD4 O60885 1/20 0.58
KDM4E B2RXH2 2/20 0.49
ADRA1D P25100 1/20 0.45
ADRA1A P35348 1/20 0.45
ADRA1B P35368 1/20 0.45
CYP2A6 P11509 2/20 0.43
NISCH Q9Y2I1 1/20 0.42
CASP1 P29466 2/20 0.41
CASP7 P55210 2/20 0.41
HSD17B10 Q99714 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
HPGD P15428 1/20 0.41
BDKRB2 P30411 1/20 0.41
MEN1 O00255 1/20 0.41
FGB P02675 1/20 0.41
ALOX15 P16050 1/20 0.41
TNNI3 P19429 1/20 0.41
MAPK1 P28482 1/20 0.41

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
SCHEMBL5488396 0.87 HTR2C (0.60) HTR2CHTR2ABRD4KDM4EADRA1D
SCHEMBL21128511 0.81 HTR2C (0.51) HTR2CHTR2ABRD4KDM4EADRA1D
Hydrochloric Acid SCHEMBL4345829 0.80 BRD4 (0.57) HTR2CHTR2ABRD4KDM4EADRA1D
SCHEMBL3399314 0.79 KMT2A (0.55) HTR2CHTR2AKDM4ECYP2A6NISCH
SCHEMBL13587950 0.78 BRD4 (0.56) HTR2CHTR2ABRD4KDM4EADRA1D
SCHEMBL5509675 0.78 HTR2C (0.50) HTR2CHTR2ABRD4KDM4ECYP2A6
SCHEMBL4866386 0.77 NPC1 (0.46) HTR2CHTR2AKDM4ECYP2A6NISCH
SCHEMBL19961723 0.77 HTR2C (0.46) HTR2CHTR2AKDM4ECYP2A6NISCH
SCHEMBL27729314 0.76 HTR2C (0.46) HTR2CHTR2AKDM4ECYP2A6NISCH
SCHEMBL25635251 0.76 HTR2C (0.52) HTR2CHTR2ABRD4KDM4EADRA1D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105218540-B A kind of preparation method of 3 thiocarbamoyl imidazoles of C simultaneously [1,2 a] pyridine compounds and their 曲阜师范大学 2017-07-04 CN disclosed
CN-103608337-B 18F-labeled precursor of PET radioactive medical supplies and preparation method thereof FUTURECHEM株式会社 2016-07-06 CN disclosed
CN-103608337-A Of PET radioactive medical articles18F-labelled precursor and process for its preparation UNIV SOGANG IND UNIV COOP FOUN 2014-02-26 CN disclosed
US-7291404-B2 Organic light emitting devices LG.PHILIPS LCD CO., LTD. (KR) 2007-11-06 US disclosed
EP-1288710-A1 Thermally developable infrared sensitive imaging materials containing heat-bleachable antihalation composition EASTMAN KODAK COMPANY (US) 2003-03-05 EP disclosed
US-6514677-B1 Thermally developable infrared sensitive imaging materials containing heat-bleachable antihalation composition EASTMAN KODAK COMPANY 2003-02-04 US disclosed
US-5676884-A Nonlinear optical materials containing polar disulfone-functionalized molecules MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1997-10-14 US disclosed
US-5578251-A NONLINEAR-OPTICAL RESPONSE; ALKYLATION MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-11-26 US disclosed
US-5360582-A Compositions with polymers for light sensitive elements MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1994-11-01 US disclosed
US-4833143-A PHENYL CYCLOBUTYL HETEROCYCLIC AMINES AND AMIDES THE BOOTS COMPANY PLC (GB) 1989-05-23 US disclosed
US-4356244-A Quinoxaline cyanine dye sensitized organic electron donor compounds MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1982-10-26 US disclosed
US-4337305-A INDOLE CYANINE DYES HAVING PHENYLSULFONYL OR BENZOYL GROUPS; LIGHT SENSITIVE ELEMENTS; ELECTROGRAPHY MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1982-06-29 US disclosed
US-4007170-A SILVER HALIDE SENSITIZERS EASTMAN KODAK COMPANY (US) 1977-02-08 US disclosed
US-3966477-A Spectrally sensitized silver halide photographic emulsion FUJI PHOTO FILM CO., LTD. (JA) 1976-06-29 US disclosed
US-3936308-A Photographic emulsions containing methine dyes having a 1H-imidazo[4,5-b]pyrazine nucleus EASTMAN KODAK COMPANY (US) 1976-02-03 US disclosed
US-3935010-A IMIDAZOQUINOXALINE DESENSITIZER EASTMAN KODAK COMPANY (US) 1976-01-27 US disclosed