SCHEMBL9420844

SCHEMBL9420844

COc1ccc2nc(N(C)C)ccc2c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NCF1 P14598 2/20 0.59
▸ NQO1 P15559 1/20 0.56
▸ APP P05067 4/20 0.48
▸ CYP1A2 P05177 2/20 0.47
▸ CYP2A6 P11509 1/20 0.47
▸ KDM4E B2RXH2 2/20 0.46
▸ MEN1 O00255 2/20 0.46
▸ NPC1 O15118 2/20 0.46
▸ RAB9A P51151 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ POLB P06746 1/20 0.46
▸ NQO2 P16083 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ GLA P06280 1/20 0.46
▸ GAA P10253 1/20 0.46
▸ EGFR P00533 1/20 0.45
▸ HDAC3 O15379 1/20 0.44
▸ HDAC4 P56524 1/20 0.44

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
SCHEMBL30301243 1.00 NCF1 (0.59) NCF1NQO1APPCYP1A2CYP2A6
Pyrimidine SCHEMBL11293693 0.89 NCF1 (0.49) NCF1NQO1APPCYP1A2CYP2A6
SCHEMBL13127338 0.80 MAPT (0.65) NCF1NQO1APPKDM4ENPC1
SCHEMBL21282206 0.77 OXTR (0.48) NCF1NQO1APPNPC1RAB9A
SCHEMBL2162844 0.76 APP (0.57) NCF1NQO1APPKDM4EMEN1
SCHEMBL31143623 0.76 CYP1A2 (0.59) NCF1APPCYP1A2CYP2A6KDM4E
SCHEMBL8275784 0.76 CYP1A2 (0.59) NCF1APPCYP1A2CYP2A6KDM4E
SCHEMBL30081476 0.76 NCF1 (0.65) NCF1NQO1CYP1A2CYP2A6KDM4E
SCHEMBL806266 0.76 NCF1 (0.65) NCF1NQO1CYP1A2CYP2A6KDM4E
SCHEMBL31018930 0.75 APP (0.46) NCF1NQO1APPKDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240376246-A1 ONE-POT PROCESS FOR THE PRODUCTION OF POLYCARBODIIMIDE CURED POLYMERS BASF SE (DE) 2024-11-14 — — US disclosed
CN-117980366-A One pot process for producing polycarbodiimide cured polymers 巴斯夫欧洲公司 2024-05-03 — — CN disclosed
WO-2023041443-A1 ONE-POT PROCESS FOR THE PRODUCTION OF POLYCARBODIIMIDE CURED POLYMERS BASF SE (DE) 2023-03-23 — — WO disclosed
US-5344972-A Isomerization, methyl formate and carbon monoxide MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1994-09-06 — — US disclosed
US-5138093-A Process for preparing ethylidene diacetate EASTMAN KODAK COMPANY (US) 1992-08-11 — — US disclosed
US-4843170-A Process for producing vinyl acetate MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1989-06-27 — — US disclosed
US-4659865-A CHEAPER CATALYST COMPRISING OF NICKEL COBALT AND IODIDES COMPOUNDS MITSUBISHI GAS CHEMICAL CO., INC. (JP) 1987-04-21 — — US disclosed
US-4626551-A ETHYLENE GLYCOL; RHODIUM CARBONYL CATALYST COMPLEX, TETRAGLYME AND SULFOLANE SOLVENT MIXTURE UNION CARBIDE CORPORATION (US) 1986-12-02 — — US disclosed
US-4620033-A CATALYST OF NICKEL COMPOUND, IODIDE COMPOUND AND PROMOTER OF TIN COMPOUND AND LITHIUM COMPOUND MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1986-10-28 — — US disclosed
US-4590216-A SYNTHESIS GAS UNION CARBIDE CORPORATION (US) 1986-05-20 — — US disclosed
US-4115433-A RHODIUM CARBONYL SULFUR CLUSTER COMPOUND UNION CARBIDE CORPORATION (US) 1978-09-19 — — US disclosed
US-4115428-A RHODIUM CARBONYL CARBIDO CLUSTER COMPOUND UNION CARBIDE CORPORATION (US) 1978-09-19 — — US disclosed
US-4013700-A QUATERNARY PHOSPHONIUM AND RHODIUM CARBONYL COMPLEX UNION CARBIDE CORPORATION (US) 1977-03-22 — — US disclosed
US-4001289-A SOLVENT EXTRACTION, RHODIUM CARBONYL, ETHYLENE GLYCOL UNION CARBIDE CORPORATION (US) 1977-01-04 — — US disclosed
US-3974259-A CATALYSTS UNION CARBIDE CORPORATION (US) 1976-08-10 — — US disclosed
US-3968136-A FROM LACTONES, RHODIUM CARBONYL COMPLEX UNION CARBIDE CORPORATION (US) 1976-07-06 — — US disclosed
US-3957857-A CATALYTIC PROCESS FOR POLYHYDRIC ALCOHOLS AND DERIVATIVES UNION CARBIDE CORPORATION (US) 1976-05-18 — — US disclosed
US-3952039-A ALKALI METAL CATION, RHODIUM CARBONYL UNION CARBIDE CORPORATION (US) 1976-04-20 — — US disclosed
US-3948965-A BIS (TRIORGANO PHOSPHINE) IMINIUM UNION CARBIDE CORPORATION (US) 1976-04-06 — — US disclosed
US-3940432-A AND METHANOL FROM HYDROGEN AND CARBON MONOXIDE, RHODIUM CARBONYL CATALYST UNION CARBIDE CORPORATION (US) 1976-02-24 — — US disclosed
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