SCHEMBL213933

SCHEMBL213933

O=CNc1ccc2ccccc2n1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NCF1 P14598 1/20 0.59
NPC1 O15118 12/20 0.50
RAB9A P51151 10/20 0.50
KMT2A Q03164 4/20 0.49
KDM4E B2RXH2 4/20 0.45
PKM P14618 1/20 0.45
SMN1; SMN2 Q16637 4/20 0.44
NFKB1 P19838 2/20 0.44
NFKB2 Q00653 2/20 0.44
RELA Q04206 2/20 0.44
MAPT P10636 2/20 0.44
TP53 P04637 2/20 0.44
HTT P42858 2/20 0.44
ADORA3 P0DMS8 1/20 0.44
ADORA2A P29274 1/20 0.44
ADORA2B P29275 1/20 0.44
ADORA1 P30542 1/20 0.44
PAX8 Q06710 1/20 0.44
MEN1 O00255 1/20 0.44
HPGD P15428 1/20 0.44

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
Hydrochloric Acid SCHEMBL27836536 0.98 NCF1 (0.57) NCF1NPC1RAB9AKMT2AKDM4E
Hydrochloric Acid SCHEMBL27836524 0.98 NCF1 (0.57) NCF1NPC1RAB9AKMT2AKDM4E
SCHEMBL14536426 0.80 NCF1 (0.59) NCF1NPC1RAB9AKMT2AKDM4E
SCHEMBL22926862 0.78 BACE1 (0.53) NCF1NPC1RAB9A
SCHEMBL4937771 0.77 NCF1 (0.65) NCF1NPC1RAB9AKMT2AKDM4E
SCHEMBL4937770 0.77 NCF1 (0.65) NCF1NPC1RAB9AKMT2AKDM4E
SCHEMBL30760998 0.76 NCF1 (0.71) NCF1NPC1RAB9AKMT2AKDM4E
SCHEMBL10458402 0.76 NCF1 (0.71) NCF1NPC1RAB9AKMT2AKDM4E
SCHEMBL1998487 0.76 PDGFRB (0.56) NPC1RAB9AKMT2AKDM4ESMN1; SMN2
SCHEMBL22545240 0.76 NCF1 (0.53) NCF1NPC1RAB9AKMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106458985-B 6-heteroaryloxy-and 6-aryloxy-quinoline-2-carboxamides and their use 艾伯维公司 2019-05-03 CN claimed
CN-109641886-A bicyclic BET bromodomain inhibitors and uses thereof 康威基内有限公司 2019-04-16 CN claimed
CN-106467541-B Substituted quinolone analog derivative or its pharmaceutically acceptable salt or stereoisomer and its Pharmaceutical composition and application 暨南大学 2019-04-05 CN claimed
CN-109232396-A Amide pyridine derivatives and application thereof 聊城大学 2019-01-18 CN claimed
CN-108727416-A The miscellaneous aroma system amide derivatives of tricyclic and its preparation and use 北京大学 2018-11-02 CN claimed
CN-108697709-A Methods for treating huntington's disease PTC医疗公司 2018-10-23 CN claimed
CN-104755083-B Urea and amide derivatives of aminoalkyl piperazine and application thereof 南方研究所 2018-04-10 CN claimed
CN-105636953-B 1,4 dibasic pyridyl derivatives and its purposes for treating the illness related to SMN shortages 诺华股份有限公司 2018-01-02 CN claimed
CN-107428729-A COMPOUNDS FOR THE TREATMENT OF CANCER 豪夫迈·罗氏有限公司 2017-12-01 CN claimed
CN-107001345-A Hete rocyclic derivatives and application thereof 株式会社C&C新药研究所 2017-08-01 CN claimed
CN-102917590-A Trycyclic compounds and pbk inhibitors containing the same ONCOTHERAPY SCIENCE INC 2013-02-06 CN claimed
CN-102388053-A Hydroxythienoquinolones and related compounds as anti-infective agents ACHILLION PHARMACEUTICALS INC 2012-03-21 CN claimed
CN-102105437-A Adamantyl diamide derivatives and uses of same LUNDBECK & CO AS H 2011-06-22 CN claimed
CN-101990433-A Compounds that enhance atoh-1 expression BRIGHAM & WOMENS HOSPITAL 2011-03-23 CN claimed
CN-100475207-C 1H-imidazo[4,5-c]quinoline derivatives in the treatment of protein kinase dependent diseases NOVARTIS AG (CH) 2009-04-08 CN claimed
CN-1867572-A proteasome inhibitors and methods of use thereof CEPHALON INC (US) 2006-11-22 CN claimed
CN-1655788-A 1H-imidazo[4,5-c]quinoline derivatives in the treatment of protein kinase dependent diseases NOVARTIS AG (CH) 2005-08-17 CN claimed
US-5919928-A Phenanthridine derivatives and metal complexes thereof used for transparent recording medium or optical recording medium NIPPON PAPER INDUSTRIES, CO., LTD. (JP) 1999-07-06 US claimed
US-5892042-A OPTICAL RECORDING MEDIA WITH ACRIDINE DYES ON TRANSPARENT SUBSTRATE NIPPON PAPER INDUSTRIES CO., LTD. (JP) 1999-04-06 US claimed
US-5792863-A HAVING LARGE ABSORPTION IN NEAR INFRARED, REDUCED ABSORPTION IN VISIBLE RANGE NIPPON PAPER INDUSTRIES CO., LTD. (JP) 1998-08-11 US claimed