SCHEMBL101727

SCHEMBL101727

CC(C)c1cc(Cc2cc(C(C)C)c(N)c(C(C)C)c2)cc(C(C)C)c1N

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHFR P00374 1/20 0.41
GSR P00390 1/20 0.38
P2RX3 P56373 1/20 0.33
P2RX2 Q9UBL9 1/20 0.33
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
THRB P10828 1/20 0.32
GAA P10253 2/20 0.31
POLB P06746 1/20 0.31
GFER P55789 1/20 0.31
ALDH1A1 P00352 2/20 0.31
GABRA1 P14867 1/20 0.31
GABRB1 P18505 1/20 0.31
GABRA5 P31644 1/20 0.31
GABRA3 P34903 1/20 0.31
GABRA2 P47869 1/20 0.31
GABRB2 P47870 1/20 0.31
GABRA4 P48169 1/20 0.31
GABRA6 Q16445 1/20 0.31
MAPT P10636 1/20 0.31

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 SCHEMBL15287283 0.98 DHFR (0.40) DHFRGSRP2RX3P2RX2CA1
SCHEMBL3870609 0.89 DHFR (0.36) DHFRTHRBGAAPOLBGFER
SCHEMBL2941908 0.89 ALDH1A1 (0.39) DHFRTHRBGAAPOLBGFER
SCHEMBL10509701 0.88 CYP3A4 (0.54) DHFRCA1CA2GFERALDH1A1
SCHEMBL29893261 0.87 DHFR (0.37) DHFRTHRBGAAPOLBGFER
SCHEMBL15488 0.87 DHFR (0.37) DHFRTHRBGAAPOLBGFER
SCHEMBL9324526 0.87 DHFR (0.37) DHFRGSRTHRBGAAPOLB
SCHEMBL3943098 0.86 THRB (0.47) DHFRTHRBGAAPOLBALDH1A1
SCHEMBL292418 0.86 POLB (0.39) DHFRGSRP2RX3P2RX2POLB
SCHEMBL14640854 0.86 DHFR (0.38) DHFRGSRP2RX3P2RX2POLB

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

Appears in 2871 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12503546-B2 Curable polyurethane prepolymer composition URETHANE SYSTEMS USA LLC (US) 2025-12-23 US claimed
EP-4296297-B1 EPOXY RESIN COMPOSITION FOR FIBER-REINFORCED COMPOSITE MATERIAL, FIBER-REINFORCED COMPOSITE MATERIAL, AND METHOD FOR PRODUCING FIBER-REINFORCED COMPOSITE MATERIAL TORAY INDUSTRIES (JP) 2025-11-05 EP claimed
US-20250250460-A1 COATING KIT AND METHOD FOR REPAIR AND/OR RECONSTITUTION OF RUBBER AND/OR METAL WORN AREAS BERTECH PANAMA S.A. (PA) 2025-08-07 US claimed
EP-4153647-B1 POLYUREA COMPOSITIONS WITH LOW CONTENTS OF RESIDUAL MONOMERIC DIISOCYANATES SIKA TECH AG (CH) 2024-04-10 EP claimed
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-11926701-B2 Polycarbonate polyols, polyisocyanate prepolymers and polyurethane and polyurethane urea elastomers based thereon COVESTRO DEUTSCHLAND AG (DE) 2024-03-12 US claimed
US-20240026067-A1 POLYMERIC MANNICH BASE, PREPARATION METHODS AND USE AS AN EPOXY RESIN CURATIVE JONES PAUL (GB) 2024-01-25 US claimed
WO-2023233151-A1 PROCESS FOR PREPARING BIO-BASED CURED EPOXY RESIN, AND BIO-BASED RESINS OBTAINABLE THEREFROM JONES PAUL (GB) 2023-12-07 WO claimed
CN-117024284-A Preparation method of 4,4' -methylenebis (2, 6-diisopropylaniline) 福建仁豪生物科技有限公司 2023-11-10 CN claimed
US-20230357489-A1 MANNICH BASE EPOXY CURATIVE, CURED EPOXY RESINS THEREOF AND METHODS OF PREPARING THE SAME JONES PAUL (GB) 2023-11-09 US claimed
US-4519965-A ZINC CARBOXYLATE AND NITROGEN CONTAINING ACYCLIC COMPOUND MOBAY CHEMICAL CORPORATION (US) 1985-05-28 US claimed
US-4456541-A Antioxidant diamine ETHYL CORPORATION (US) 1984-06-26 US claimed
EP-0044481-B1 PROCESS FOR THE PRODUCTION OF ELASTOMERIC MOULDED PRODUCTS Mobay Chemical Corporation (US) 1984-06-13 EP claimed
US-4379105-A Process for the production of elastic shaped articles MOBAY CHEMICAL CORPORATION (US) 1983-04-05 US claimed
EP-0075130-A2 Improved reaction injection molding process THE DOW CHEMICAL COMPANY (US) 1983-03-30 EP claimed
US-4374210-A MOLDING MATERIALS; LONG GELATION TIME; STOICHIOMETRY; INJECTION MOLDING THE UPJOHN COMPANY (US) 1983-02-15 US claimed
US-4324867-A FROM A POLYETHER, ISOCYANATE, DIAMINODIPHENYLALKANE MIXTURE BASF WYANDOTTE CORPORATION (US) 1982-04-13 US claimed
EP-0044481-A1 Process for the production of elastomeric moulded products Mobay Chemical Corporation (US) 1982-01-27 EP claimed
US-4296212-A MOLDING MATERIALS THE UPJOHN COMPANY (US) 1981-10-20 US claimed
US-4289906-A Chemical process for preparing methylene bis-anilines ETHYL CORPORATION (US) 1981-09-15 US claimed