SCHEMBL250171

SCHEMBL250171

O=C(c1nc2ccccc2[nH]1)c1nc2ccccc2[nH]1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCND3 P30281 1/20 0.70
CDK6 Q00534 1/20 0.70
AURKA O14965 1/20 0.63
JAK2 O60674 1/20 0.63
ABL1 P00519 1/20 0.63
NTRK1 P04629 1/20 0.63
LCK P06239 1/20 0.63
FYN P06241 1/20 0.63
CSF1R P07333 1/20 0.63
RET P07949 1/20 0.63
IGF1R P08069 1/20 0.63
MET P08581 1/20 0.63
PDGFRB P09619 1/20 0.63
PIM1 P11309 1/20 0.63
FGFR1 P11362 1/20 0.63
PRKACA P17612 1/20 0.63
KDR P35968 1/20 0.63
MAP2K2 P36507 1/20 0.63
CDK8 P49336 1/20 0.63
GSK3A P49840 1/20 0.63

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 SCHEMBL7000982 0.98 CCND3 (0.68) CCND3CDK6AURKAJAK2ABL1
SCHEMBL7199487 0.90 CCND3 (0.69) CCND3CDK6AURKAJAK2ABL1
SCHEMBL3966827 0.89 CCND3 (0.67) CCND3CDK6AURKAJAK2ABL1
SCHEMBL3417204 0.87 CCND3 (0.60) CCND3CDK6AURKAJAK2ABL1
SCHEMBL5358948 0.86 AURKA (0.61) CCND3CDK6AURKAJAK2ABL1
SCHEMBL29414293 0.86 AURKA (0.61) CCND3CDK6AURKAJAK2ABL1
SCHEMBL160155 0.86 AURKA (0.61) CCND3CDK6AURKAJAK2ABL1
SCHEMBL11765083 0.85 KDM4E (0.60) CCND3CDK6AURKAJAK2ABL1
SCHEMBL9373255 0.84 CCND3 (0.61) CCND3CDK6AURKAJAK2ABL1
SCHEMBL1303899 0.84 CCND3 (0.61) CCND3CDK6AURKAJAK2ABL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117386893-A Multilayer composite antibacterial PE water supply pipeline and preparation process thereof 江苏惠升管业集团有限公司 2024-01-12 CN claimed
CN-107603201-A A kind of ornaments and dentistry hot investment casting 3D printing photosensitive resin 金华市聚臻新材料科技有限公司 2018-01-19 CN claimed
CN-104789105-B Anti-cavitation polyurethane composition and the method that film is formed with said composition 纳路涂料股份有限公司 2017-06-13 CN claimed
CN-102300860-B Pyrazine Compounds As Phosphodiesterase 10 Inhibitors AMGEN INC 2014-08-27 CN claimed
CN-102300860-A Pyrazine compounds as phosphodiesterase 10 inhibitors 2011-12-28 CN claimed
CN-101224933-B Treatment method for zero discharge of ionic liquid water solution CHINESE ACAD INST CHEMISTRY 2010-12-29 CN claimed
CN-100556875-C A kind of reverse osmosis-distillation integration process that reclaims glycerine in the low-concentration sweet water UNIV ZHEJIANG (CN) 2009-11-04 CN claimed
CN-101224933-A Treatment method for zero discharge of ionic liquid water solution CHINESE ACAD INST CHEMISTRY (CN) 2008-07-23 CN claimed
CN-101139255-A Hyperfiltration-distillation integration process for reclaiming glycerin from low-concentration sweet water UNIV ZHEJIANG (CN) 2008-03-12 CN claimed
CN-1300262-C Application of super hydrophilicity and/or super lipophilicity nano pore material CHINESE ACAD INST CHEMISTRY (CN) 2007-02-14 CN claimed
CN-1693377-A Application of super hydrophilicity and/or super lipophilicity nano pore material CHINESE ACAD INST CHEMISTRY (CN) 2005-11-09 CN claimed
EP-1189889-B1 COMPOSITIONS AND METHODS FOR INHIBITING CELL DEATH ELAN PHARMA INT LTD (IE) 2003-12-17 EP claimed
US-6541486-B1 Used for treating ischemia, such as results from stroke or myocardial infarction, trauma, neurodegeneration, and inflammation. ELAN PHARMA INTERNATIONAL LTD. (IE) 2003-04-01 US claimed
EP-1189889-A1 COMPOSITIONS AND METHODS FOR INHIBITING CELL DEATH Elan Pharma International Limited (IE) 2002-03-27 EP claimed
WO-2000075117-A1 COMPOSITIONS AND METHODS FOR INHIBITING CELL DEATH ELAN PHARMA INTERNATIONAL LTD. (IE) 2000-12-14 WO claimed
CN-119930404-A Method for synthesizing butanol from ethanol 南京理工大学 2025-05-06 CN disclosed
CN-117386893-A Multilayer composite antibacterial PE water supply pipeline and preparation process thereof 江苏惠升管业集团有限公司 2024-01-12 CN disclosed
EP-0265495-A4 BONDED PHASE CHROMATOGRAPHIC SUPPORTS. ANALYTICHEM INT INC (US) 1988-11-23 EP disclosed
EP-0265495-A1 BONDED PHASE CHROMATOGRAPHIC SUPPORTS ANALYTICHEM INTERNATIONAL, INC. (US) 1988-05-04 EP disclosed
WO-1987006586-A1 BONDED PHASE CHROMATOGRAPHIC SUPPORTS ANALYTICHEM INTERNATIONAL, INC. (US) 1987-11-05 WO disclosed