SCHEMBL100769

SCHEMBL100769

CC(C)c1cc(Cc2ccc(N)c(C(C)C)c2)ccc1N

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 4/20 0.51
ALDH1A1 P00352 4/20 0.48
GAA P10253 3/20 0.48
KDM4E B2RXH2 2/20 0.48
MAPT P10636 2/20 0.48
CYP3A4 P08684 2/20 0.48
MEN1 O00255 1/20 0.48
POLB P06746 1/20 0.48
RAB9A P51151 1/20 0.48
KMT2A Q03164 1/20 0.48
CDC25B P30305 1/20 0.42
CASP6 P55212 1/20 0.42
RCE1 Q9Y256 1/20 0.42
TSHR P16473 2/20 0.42
HPGD P15428 1/20 0.42
ALOX15 P16050 1/20 0.42
HSD17B10 Q99714 1/20 0.42
TDP1 Q9NUW8 1/20 0.37
ADORA3 P0DMS8 1/20 0.37
ADORA2A P29274 1/20 0.37

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
SCHEMBL29942793 1.00 THRB (0.51) THRBALDH1A1GAAKDM4EMAPT
SCHEMBL10942694 0.92 ALDH1A1 (0.52) THRBALDH1A1GAAKDM4EMAPT
SCHEMBL3943098 0.92 THRB (0.47) THRBALDH1A1GAAKDM4EMAPT
SCHEMBL3937517 0.91 THRB (0.52) THRBALDH1A1GAAKDM4EMAPT
SCHEMBL3942470 0.88 THRB (0.47) THRBALDH1A1GAAKDM4EMAPT
SCHEMBL2170430 0.87 THRB (0.44) THRBALDH1A1GAAKDM4EMAPT
SCHEMBL27454547 0.85 THRB (0.43) THRBALDH1A1MAPTRAB9AADORA3
SCHEMBL27087991 0.85 ALDH1A1 (0.44) THRBALDH1A1GAAKDM4EMAPT
SCHEMBL27087994 0.85 ALDH1A1 (0.44) THRBALDH1A1GAAKDM4EMAPT
SCHEMBL117548 0.85 THRB (0.45) THRBALDH1A1GAAKDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024052724-A1 COATING KIT AND METHOD FOR REPAIR AND/OR RECONSTITUTION OF RUBBER AND/OR METAL WORN AREAS BERTECH PANAMÁ S.A. (PA) 2024-03-14 WO claimed
US-20130165603-A1 Adhesive Composition And Adhesive Film Comprising The Same CHEIL INDUSTRIES, INC. (KR) 2013-06-27 US claimed
EP-2426157-A1 Diamine compositions and use thereof Lonza Ltd. (CH) 2012-03-07 EP claimed
US-20100144467-A1 COMPOSITIONS USEFUL IN GOLF BALLS THE HANSON GROUP, LLC (US) 2010-06-10 US claimed
WO-2008150865-A2 COMPOSITIONS USEFUL IN GOLF BALLS THE HANSON GROUP LLC (US) 2008-12-11 WO claimed
EP-0579989-B1 Polyurethaneurea elastomer IHARA CHEMICAL IND CO (JP) 1997-09-03 EP claimed
US-5410009-A Impact resilience; flexural properties IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 1995-04-25 US claimed
EP-0579989-A1 Polyurethaneurea elastomer IHARA CHEMICAL INDUSTRY Co., Ltd. (JP) 1994-01-26 EP claimed
US-5039775-A Process for producing polyurea resin IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 1991-08-13 US claimed
US-12435248-B2 Temporary protective film for semiconductor encapsulation molding, lead frame provided with temporary protective film, encapsulation molded body, and method for manufacturing semiconductor package RESONAC CORPORATION (JP) 2025-10-07 US disclosed
EP-4563630-A1 PREPREG, FIBER-REINFORCED COMPOSITE MATERIAL, AND FIBER-REINFORCED COMPOSITE MATERIAL MANUFACTURING METHOD Mitsubishi Chemical Corporation (JP) 2025-06-04 EP disclosed
US-20250163229-A1 PREPREG, FIBER-REINFORCED COMPOSITE ARTICLE, AND METHOD OF PRODUCING FIBER-REINFORCED COMPOSITE ARTICLE MITSUBISHI CHEMICAL CORPORATION (JP) 2025-05-22 US disclosed
EP-3828218-B1 EPOXY RESIN, EPOXY RESIN COMPOSITION, EPOXY RESIN COMPOSITION FOR CARBON FIBER-REINFORCED COMPOSITE MATERIAL, PREPREG, AND CARBON FIBER-REINFORCED COMPOSITE MATERIAL NIPPONKAYAKU KK (JP) 2024-06-26 EP disclosed
US-20240199831-A1 PREPREG AND FIBER-REINFORCED COMPOSITE MATERIAL TORAY INDUSTRIES, INC. (JP) 2024-06-20 US disclosed
US-4350777-A Impermeable molded articles of cellular polyurethane elastomers produced with organofunctional polysiloxane-derivatives and their use as spring elements BAYER AKTIENGESELLSCHAFT (DE) 1982-09-21 US disclosed
EP-0036994-A2 Process for preparing waterproof articles from cellular polyurethane elastomers and their use as spring elements BAYER AG (DE) 1981-10-07 EP disclosed
US-4280007-A USING WATER AS BLOWING AGENT AND FOR CHAIN EXTENSION WITH SMALL AMOUNTS OF AROMATIC DIAMINES BAYER AKTIENGESELLSCHAFT (DE) 1981-07-21 US disclosed
EP-0008307-A1 Polyurethane foams prepared from condensation products of amines, epihalohydrins and alkylene oxides BASF WYANDOTTE CORPORATION (US) 1980-03-05 EP disclosed
US-4144027-A SHRINKPROOFING KERATIN-CONTAINING FABRICS BY REACTION WITH A POLYETHER POLYOL AND A DIISOCYANATE MILLIKEN RESEARCH CORPORATION (US) 1979-03-13 US disclosed
US-4133780-A Polyurethane foams prepared from condensation products of amines, epihalohydrins and alkylene oxides BASF WYANDOTTE CORPORATION (US) 1979-01-09 US disclosed