SCHEMBL4493780

SCHEMBL4493780

O=C(Nc1ccc(F)cc1F)c1cccnc1Cl

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.56
TAS1R3 Q7RTX0 1/20 0.56
TAS1R1 Q7RTX1 1/20 0.56
TAS1R2 Q8TE23 1/20 0.56
KDM4E B2RXH2 2/20 0.55
MEN1 O00255 1/20 0.55
CYP1A2 P05177 1/20 0.55
CYP2C19 P33261 1/20 0.55
KMT2A Q03164 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
GRM4 Q14833 1/20 0.55
EGFR P00533 1/20 0.54
TDP1 Q9NUW8 1/20 0.53
RXFP1 Q9HBX9 2/20 0.52
TP53 P04637 1/20 0.52
POLB P06746 1/20 0.52
NPC1 O15118 1/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
HTT P42858 2/20 0.51
HPGD P15428 1/20 0.51

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
SCHEMBL32670789 1.00 MAPT (0.56) MAPTTAS1R3TAS1R1TAS1R2KDM4E
SCHEMBL29395986 1.00 MAPT (0.56) MAPTTAS1R3TAS1R1TAS1R2KDM4E
Cyclohexane SCHEMBL28734369 0.96 MAPT (0.57) MAPTTAS1R3TAS1R1TAS1R2KDM4E
SCHEMBL4494083 0.86 MAPT (0.59) MAPTTAS1R3TAS1R1TAS1R2KDM4E
SCHEMBL4932028 0.85 TDP1 (0.62) MAPTTAS1R3TAS1R1TAS1R2KDM4E
SCHEMBL28683901 0.85 MAPT (0.58) MAPTTAS1R3TAS1R1TAS1R2KDM4E
SCHEMBL18073557 0.85 KDM4E (0.57) MAPTKDM4EMEN1CYP1A2CYP2C19
SCHEMBL29800523 0.83 TDP1 (0.72) MAPTTAS1R3TAS1R1TAS1R2KDM4E
SCHEMBL4927155 0.83 TDP1 (0.65) MAPTTAS1R3TAS1R1TAS1R2KDM4E
SCHEMBL4483530 0.81 THRB (0.53) MAPTTAS1R3TAS1R1TAS1R2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114057636-A Preparation process of 2-chloro-3-N- (2, 4-difluorophenyl) nicotinamide 江苏颖盛化工有限公司 2022-02-18 CN claimed
CN-104402814-A Method for synthesizing 2-chlorine-N-(2,4-difluorophenyl) nicotinamide by one-pot method NANTONG JIAHE CHEMICALS CO LTD 2015-03-11 CN claimed
CN-114634444-A Preparation method of amide compound 泰州百力化学股份有限公司 2022-06-17 CN disclosed
CN-114380740-A Synthesis method of polysubstituted pyridine-2-oxygen ether compound 江阴苏利化学股份有限公司 2022-04-22 CN disclosed
CN-216063261-U Chlorination reation kettle is used in nicotinamide preparation 江苏颖盛化工有限公司 2022-03-18 CN disclosed
CN-216063261-U Chlorination reation kettle is used in nicotinamide preparation 江苏颖盛化工有限公司 2022-03-18 CN disclosed
CN-216062658-U Hydrogen chloride tail gas processing apparatus is used in nicotinamide production 江苏颖盛化工有限公司 2022-03-18 CN disclosed
CN-114057636-A Preparation process of 2-chloro-3-N- (2, 4-difluorophenyl) nicotinamide 江苏颖盛化工有限公司 2022-02-18 CN disclosed
CN-114057636-A Preparation process of 2-chloro-3-N- (2, 4-difluorophenyl) nicotinamide 江苏颖盛化工有限公司 2022-02-18 CN disclosed
CN-114057636-A Preparation process of 2-chloro-3-N- (2, 4-difluorophenyl) nicotinamide 江苏颖盛化工有限公司 2022-02-18 CN disclosed
EP-1937682-B1 MET KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2015-08-12 EP disclosed
US-20070078140-A1 MET kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY 2007-04-05 US disclosed
US-20070078140-A1 MET kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY 2007-04-05 US disclosed
US-20070078140-A1 MET kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY 2007-04-05 US disclosed
EP-0899262-B1 Process for the preparation of heteroarylcarboxylic amides and esters BASF AG (DE) 2005-04-06 EP disclosed
US-6320053-B1 ETHERIFICATION OF HALO-SUBSTITUTED PYRIDINE-CRABOXY ESTER OR AMIDE PREPARED FROM THE CORRESPONDING TRICHLOROMETHYL SUBSTITUTED PYRIDINE; AGROCHEMICALS OR PHARMACEUTICALS CHEMICAL INTERMEDIATES AMERICAN CYANAMID COMPANY 2001-11-20 US disclosed
US-6087506-A Preparation of hetero arylcarboxamides AMERICAN CYANAMID COMPANY (US) 2000-07-11 US disclosed
EP-0899262-A2 Process for the preparation of heteroarylcarboxylic amides and esters American Cyanamid Company (US) 1999-03-03 EP disclosed
EP-0053011-B1 NEW HERBICIDAL NICOTINAMIDE DERIVATIVES MAY & BAKER LIMITED (GB) 1985-04-03 EP disclosed
EP-0053011-A1 New herbicidal nicotinamide derivatives MAY & BAKER LIMITED (GB) 1982-06-02 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070078140-A1 MET kinase inhibitors MET, ABL1, ERBB2 MAPT 3276/4885TAS1R3 3044/4885TAS1R1 2773/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.