SCHEMBL2892472

SCHEMBL2892472

Cc1ccc(C(=O)c2c[nH]nn2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.52
LMNA P02545 2/20 0.52
SRD5A2 P31213 2/20 0.46
RAB9A P51151 4/20 0.44
NPC1 O15118 2/20 0.44
CES2 O00748 1/20 0.42
CES1 P23141 1/20 0.42
TDP1 Q9NUW8 2/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
AKR1C3 P42330 1/20 0.40
HTT P42858 3/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA4 P22748 1/20 0.39
CA9 Q16790 1/20 0.39
PKM P14618 2/20 0.38
ATM Q13315 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
HPGD P15428 2/20 0.38
NLRP1 Q9C000 1/20 0.38

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
SCHEMBL27697586 0.83 NPSR1 (0.54) ALDH1A1LMNARAB9ANPC1CES2
SCHEMBL27717747 0.82 LTA4H (0.47) ALDH1A1LMNARAB9ANPC1CES2
SCHEMBL947216 0.81 KMT2A (0.48) ALDH1A1LMNASRD5A2RAB9ANPC1
SCHEMBL27697491 0.79 CDC25B (0.46) ALDH1A1LMNARAB9ANPC1SMN1; SMN2
SCHEMBL27717744 0.78 SRD5A2 (0.50) SRD5A2RAB9ANPC1CES2CES1
Hydrogen Sulfide SCHEMBL11219494 0.76
SCHEMBL23172867 0.76 TSHR (0.62) ALDH1A1LMNASMN1; SMN2HTTCA1
SCHEMBL2892473 0.72 ALDH1A1 (0.43) ALDH1A1HPGDGAA
SCHEMBL11051578 0.71 ALDH1A1 (0.52) ALDH1A1LMNASRD5A2RAB9ANPC1
SCHEMBL52200 0.71 ALDH1A1 (1.00) ALDH1A1LMNASRD5A2RAB9ACES2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7851420-B2 Corrosion protection agent for functional fluids water-miscible concentrate and use thereof HELMUT THEUNISSEN (DE) 2010-12-14 US claimed
CN-110062790-B Stabilizer composition 巴斯夫欧洲公司 2021-09-24 CN disclosed
US-10316712-B2 Lubricant compositions for surface finishing of materials EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2019-06-11 US disclosed
EP-3389902-A1 LUBRICANT COMPOSITIONS FOR SURFACE FINISHING OF MATERIALS ExxonMobil Research and Engineering Company (US) 2018-10-24 EP disclosed
US-10081773-B2 Additive compositions that improve the stability and the engine performances of diesel fuels TOTAL MARKETING SERVICES (FR) 2018-09-25 US disclosed
WO-2017106029-A1 LUBRICANT COMPOSITIONS FOR SURFACE FINISHING OF MATERIALS EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2017-06-22 WO disclosed
US-20170175600-A1 LUBRICANT COMPOSITIONS FOR SURFACE FINISHING OF MATERIALS EXXONMOBIL RESEARCH AND ENGINEERING COMPANY 2017-06-22 US disclosed
US-9447322-B2 Corrosion inhibitor compositions comprising tetrahydrobenzotriazoles solubilized in activating solvents and methods for using same Wincom, Inc. (US) 2016-09-20 US disclosed
US-20150033617-A1 ADDITIVE COMPOSITIONS FOR IMPROVING THE LACQUERING RESISTANCE OF HIGHER GRADE FUELS OF THE DIESEL OR BIODIESEL TYPE TOTAL MARKETING SERVICES (FR) 2015-02-05 US disclosed
US-20140157655-A1 ADDITIVE COMPOSITIONS THAT IMPROVE THE STABILITY AND THE ENGINE PERFORMANCES OF DIESEL FUELS TOTAL MARKETING SERVICES (FR) 2014-06-12 US disclosed
CN-103589395-A Anti-corrosion antifreezing solution QINGDAO HAOYUAN ENVIRONMENTAL ENGINEERING TECHNOLOGY CO LTD 2014-02-19 CN disclosed
US-20140027675-A1 CORROSION INHIBITOR COMPOSITIONS COMPRISING TETRAHYDROBENZOTRIAZOLES SOLUBILIZED IN ACTIVATING SOLVENTS AND METHODS FOR USING SAME Wincom, Inc (US) 2014-01-30 US disclosed
US-8535568-B2 Corrosion inhibitor compositions comprising tetrahydrobenzotriazoles solubilized in activating solvents and methods for using same Wincom, Inc. (US) 2013-09-17 US disclosed
US-20120315185-A1 CORROSION INHIBITOR COMPOSITIONS COMPRISING TETRAHYDROBENZOTRIAZOLES SOLUBILIZED IN ACTIVATING SOLVENTS AND METHODS FOR USING SAME Wincom, Inc. (US) 2012-12-13 US disclosed
US-20120313048-A1 CORROSION INHIBITOR COMPOSITIONS COMPRISING TETRAHYDROBENZOTRIAZOLES SOLUBILIZED IN ACTIVATING SOLVENTS AND METHODS FOR USING SAME Wincom, Inc. (US) 2012-12-13 US disclosed
US-8236205-B1 Corrosion inhibitor compositions comprising tetrahydrobenzotriazoles and other triazoles and methods for using same Wincom, Inc. (US) 2012-08-07 US disclosed
US-8236204-B1 Corrosion inhibitor compositions comprising tetrahydrobenzotriazoles solubilized in activating solvents and methods for using same Wincom, Inc. (US) 2012-08-07 US disclosed
CN-101987990-A Compressor oil special additive TIANJIN GONGBO TECHNOLOGY DEV CO LTD 2011-03-23 CN disclosed
US-20100273691-A1 Method for improving the corrosion inhibiting properties of lubricant compositions BAILLARGEON DAVID J 2010-10-28 US disclosed
EP-0218798-A2 Process and composition for inhibiting corrosion and incrustation in water systems Benckiser-Knapsack GmbH (DE) 1987-04-22 EP disclosed