SCHEMBL112200

SCHEMBL112200

NCc1ccc(Cl)c(Cl)c1

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PNMT P11086 3/20 0.67
TAAR1 Q96RJ0 1/20 0.67
IDO1 P14902 5/20 0.58
CSNK2A1 P68400 9/20 0.55
SIGMAR1 Q99720 2/20 0.53
LOXL2 Q9Y4K0 1/20 0.49
CSNK2A2 P19784 1/20 0.47
CSNK2B P67870 1/20 0.47
CSNK2A3 Q8NEV1 1/20 0.47

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
SCHEMBL29349576 1.00 PNMT (0.67) PNMTTAAR1IDO1CSNK2A1SIGMAR1
Hydrochloric Acid SCHEMBL3127848 0.97 PNMT (0.64) PNMTTAAR1IDO1CSNK2A1SIGMAR1
Ammonia Solution, Strong SCHEMBL9178453 0.97 PNMT (0.64) PNMTTAAR1IDO1CSNK2A1SIGMAR1
SCHEMBL5558540 0.81 TAAR1 (0.62) PNMTTAAR1IDO1CSNK2A1SIGMAR1
SCHEMBL8349185 0.81 KDM4E (0.56) PNMTTAAR1IDO1CSNK2A1SIGMAR1
SCHEMBL879052 0.80 CYP3A4 (0.71) PNMTTAAR1CSNK2A1LOXL2CSNK2A2
SCHEMBL29467979 0.80 CYP3A4 (0.71) PNMTTAAR1CSNK2A1LOXL2CSNK2A2
SCHEMBL638305 0.80 TP53 (0.52) PNMTTAAR1CSNK2A1LOXL2CSNK2A2
SCHEMBL8847353 0.80 PNMT (0.50) PNMTTAAR1CSNK2A1LOXL2CSNK2A2
SCHEMBL2006591 0.80 CSNK2A1 (0.52) PNMTTAAR1IDO1CSNK2A1LOXL2

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 2049 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117924210-A Preparation method of 2-iminothiazolidine-4-ketone compound 赣南师范大学 2024-04-26 CN claimed
CN-115851027-B Leveling agent and preparation method and application thereof 广东科德环保科技股份有限公司 2023-08-08 CN claimed
CN-115851027-A Leveling agent and preparation method and application thereof 广东科德环保科技股份有限公司 2023-03-28 CN claimed
CN-113214236-B Preparation method of thiophene bi-1, 3, 4-oxadiazole formamide compounds, products and application thereof 南京林业大学 2022-01-04 CN claimed
CN-106946828-B Scopolactone phenol ether derivative and its preparation method and application 西南大学 2019-02-26 CN claimed
US-9833768-B2 Affinity reagents for protein purification IMPOSSIBLE FOODS INC. (US) 2017-12-05 US claimed
US-20170320041-A1 AFFINITY REAGENTS FOR PROTEIN PURIFICATION IMPOSSIBLE FOODS INC. 2017-11-09 US claimed
US-9737875-B2 Affinity reagents for protein purification IMPOSSIBLE FOODS INC. (US) 2017-08-22 US claimed
CN-106946828-A Scopolactone phenol ether derivative and its preparation method and application 西南大学 2017-07-14 CN claimed
EP-1028124-B2 Improved deprotection method for the synthesis of oligomeric compounds ISIS PHARMACEUTICALS INC (US) 2016-01-27 EP claimed
WO-1997016428-A1 ISOQUINOLINE DERIVATIVES AND ISOQUINOLINE COMBINATORIAL LIBRARIES TORREY PINES INSTITUTE FOR MOLECULAR STUDIES (US) 1997-05-09 WO claimed
EP-0507317-B1 Biguanide derivatives, manufacturing method thereof, and disinfectants containing the derivatives OTSUKA PHARMA CO LTD (JP) 1997-01-15 EP claimed
CN-1065453-A Biguanide derivative, its manufacture method and the Herb of Common violet that contains this derivative OTSUKA CHEMICAL CO LTD (JP) 1992-10-21 CN claimed
EP-0507317-A2 Biguanide derivatives, manufacturing method thereof, and disinfectants containing the derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1992-10-07 EP claimed
EP-0331052-A2 Process for the preparation of imidized acrylic polymers ELF ATOCHEM ITALIA S.r.l. (IT) 1989-09-06 EP claimed
US-4342869-A Cephalosporin antibiotics MERCK & CO., INC. (US) 1982-08-03 US claimed
US-4338437-A Cephalosporin antibiotics MERCK & CO., INC. (US) 1982-07-06 US claimed
US-4338438-A Cephalosporin antibiotics MERCK & CO., INC. (US) 1982-07-06 US claimed
US-4310459-A Process for producing carbamoyl substituted penams and carbamoyl substituted cephams from penicillin sulfoxide esters BRISTOL-MYERS COMPANY (US) 1982-01-12 US claimed
US-4297488-A 7-α-Methoxy cephalosporins MERCK & CO., INC. (US) 1981-10-27 US claimed