SCHEMBL821094

SCHEMBL821094

C=CCNc1ccc(Nc2ccccc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.54
HSD17B10 Q99714 5/20 0.54
ALOX12 P18054 4/20 0.54
L3MBTL1 Q9Y468 4/20 0.54
TSHR P16473 3/20 0.54
TDP1 Q9NUW8 3/20 0.54
ALOX15 P16050 2/20 0.54
PTGS1 P23219 1/20 0.54
SLC6A2 P23975 1/20 0.54
MAPK1 P28482 1/20 0.54
PTGS2 P35354 1/20 0.54
HTR2B P41595 1/20 0.54
CA12 O43570 1/20 0.52
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
CA9 Q16790 1/20 0.52
CASP3 P42574 1/20 0.45
SENP7 Q9BQF6 1/20 0.45
MAPT P10636 8/20 0.45
HPGD P15428 4/20 0.45

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
SCHEMBL11051 0.91 CA12 (0.53) ALDH1A1L3MBTL1CA12CA1CA2
SCHEMBL16371883 0.91 CA12 (0.53) ALDH1A1L3MBTL1CA12CA1CA2
SCHEMBL1585896 0.91 CA12 (0.59) ALDH1A1HSD17B10ALOX12L3MBTL1TSHR
SCHEMBL28296540 0.89 CA12 (0.52) ALDH1A1L3MBTL1CA12CA1CA2
Hydrochloric Acid SCHEMBL728400 0.89 CA12 (0.52) ALDH1A1L3MBTL1CA12CA1CA2
Water SCHEMBL10657216 0.89 CA12 (0.52) ALDH1A1L3MBTL1CA12CA1CA2
Iodide SCHEMBL11631405 0.89 CA12 (0.52) ALDH1A1L3MBTL1CA12CA1CA2
SCHEMBL10385905 0.89 CA12 (0.52) ALDH1A1L3MBTL1CA12CA1CA2
SCHEMBL253353 0.89 CA12 (0.52) ALDH1A1L3MBTL1CA12CA1CA2
Cyanide SCHEMBL29655773 0.85 CA12 (0.48) ALDH1A1L3MBTL1CA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108602963-B Process for preparing a masterbatch comprising a diene elastomer, an organic reinforcing filler and optionally an antioxidant 米其林集团总公司 2023-10-10 CN claimed
CN-108602962-B For preparing a composition comprising a diene elastomer method for masterbatch of organic reinforcing filler and antioxidant 米其林集团总公司 2023-10-10 CN claimed
CN-114539074-A Refining method of N-alkyl-N' -phenyl-p-phenylenediamine 山东阳谷华泰化工股份有限公司 2022-05-27 CN claimed
CN-112501398-A Anti-emulsification type overspeed quenching oil composition, preparation method and application thereof 中国石油化工股份有限公司 2021-03-16 CN claimed
CN-109022713-B Anti-emulsification quenching oil composition and application thereof 中国石油化工股份有限公司 2020-11-06 CN claimed
EP-1741772-B1 Use of lubricating oil compositions for EGR equipped diesel engines INFINEUM INT LTD (GB) 2018-09-12 EP claimed
US-20150031810-A1 Rubber Composition for Tire Including a Novel Anti-oxidant System MICHELIN SOC TECH (FR) 2015-01-29 US claimed
US-8833417-B2 Rubber composition for tire including a novel anti-oxidant system MICHELIN RECHERCHE ET TECHNIQUES S.A. (CH) 2014-09-16 US claimed
EP-1902106-B1 PRIMER COMPOSITIONS FOR ADHESIVE BONDING SYSTEMS HENKEL CORP (US) 2014-08-20 EP claimed
EP-2029704-B1 ANTIOXIDANT ADDITIVE FOR BIODIESEL FUELS CHEMTURA CORP (US) 2012-08-01 EP claimed
WO-2004018569-A1 METHOD FOR PRODUCING ADDITIVE CARBON BLACK COLUMBIAN CHEMICALS COMPANY (US) 2004-03-04 WO claimed
US-20030207126-A1 Cure accelerators for anaerobic adhesive compositions LOCTITE CORPORATION 2003-11-06 US claimed
EP-1276804-A1 LIQUID ANTIOZONANTS AND RUBBER COMPOSITIONS CONTAINING SAME Uniroyal Chemical Company, Inc. (US) 2003-01-22 EP claimed
US-20020165302-A1 Mixing an amine antidegradant with carbon black, free of a solvent or carrier; improving dispersion, viscosity when mixing with rubber, time reduction, cost savings and reduces environmental impact COLUMBIAN CHEMICALS COMPANY 2002-11-07 US claimed
US-20020061946-A1 Liquid antiozonants and rubber compositions containing same ADDIVANT USA, LLC 2002-05-23 US claimed
WO-2001081459-A1 LIQUID ANTIOZONANTS AND RUBBER COMPOSITIONS CONTAINING SAME UNIROYAL CHEMICAL COMPANY, INC. (US) 2001-11-01 WO claimed
US-5068438-A Granulation and rotation with heat treatment to form free-flowing particles MITSUBISHI MONSANTO CHEMICAL COMPANY (JP) 1991-11-26 US claimed
US-4764547-A WITH AMINE OR QUINOLINE COMPOUND BRIDGESTONE CORPORATION (JP) 1988-08-16 US claimed
US-4647328-A Process for making belted tires free of undertread cements THE UNIROYAL GOODRICH TIRE COMPANY (US) 1987-03-03 US claimed
US-4013638-A VULCANIZATION ACCELERATORS, OXIDATION INHIBITORS OF RUBBER MONSANTO COMPANY (US) 1977-03-22 US claimed