SCHEMBL220702

SCHEMBL220702

CC(C)C1C2CCC1c1c(N)cccc12

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.35
SIGMAR1 Q99720 2/20 0.33
GID4 Q8IVV7 1/20 0.31
CYP3A4 P08684 1/20 0.30
TSHR P16473 1/20 0.30
PIK3CA P42336 1/20 0.30

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
SCHEMBL30367212 1.00 PNMT (0.35) PNMTSIGMAR1GID4CYP3A4TSHR
SCHEMBL12023267 1.00 PNMT (0.35) PNMTSIGMAR1GID4CYP3A4TSHR
SCHEMBL15800482 1.00 PNMT (0.35) PNMTSIGMAR1GID4CYP3A4TSHR
SCHEMBL30366945 1.00 PNMT (0.35) PNMTSIGMAR1GID4CYP3A4TSHR
SCHEMBL437168 1.00 PNMT (0.35) PNMTSIGMAR1GID4CYP3A4TSHR
SCHEMBL2496114 0.79 SIGMAR1 (0.38) PNMTSIGMAR1CYP3A4
SCHEMBL14335852 0.77 SIGMAR1 (0.42) SIGMAR1
SCHEMBL13071176 0.77 PNMT (0.38) PNMTGID4CYP3A4TSHRPIK3CA
SCHEMBL14701851 0.77 PNMT (0.38) PNMTGID4CYP3A4TSHRPIK3CA
SCHEMBL10140287 0.76 PNMT (0.33) PNMT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116924989-A Synthesis method of 3- (difluoromethyl) -1-methyl-1H-pyrazole-4-carboxylic acid 山东润博生物科技有限公司 2023-10-24 CN disclosed
EP-3677572-B1 PRODUCTION METHOD FOR PYRAZOLE-4-CARBOXAMIDE DERIVATIVE JAPAN FINECHEM COMPANY INC (JP) 2023-06-07 EP disclosed
EP-3677572-A1 PRODUCTION METHOD FOR PYRAZOLE-4-CARBOXAMIDE DERIVATIVE Japan Finechem Company, Inc. (JP) 2020-07-08 EP disclosed
US-20200181091-A1 PRODUCTION METHOD FOR PYRAZOLE-4-CARBOXAMIDE DERIVATIVE JAPAN FINECHEM COMPANY, INC. (JP) 2020-06-11 US disclosed
CN-110891940-A Process for preparing pyrazole-4-carboxamide derivatives 日本凡凯姆股份有限公司 2020-03-17 CN disclosed
EP-3604282-A1 METHOD FOR PRODUCING HALOGEN-CONTAINING PYRAZOL CARBOXYLIC ACID AND INTERMEDIATE THEREOF AGC Inc. (JP) 2020-02-05 EP disclosed
EP-3604283-A1 PRODUCTION METHOD FOR HALOGENATED PYRAZOLECARBOXYLIC ACID AGC Inc. (JP) 2020-02-05 EP disclosed
US-20190225585-A1 METHOD OF PRODUCING FLUORINE-CONTAINING PYRAZOLE CARBOXYLIC ACID HALIDE AGC Inc. (JP) 2019-07-25 US disclosed
EP-3492453-A1 METHOD OF PRODUCING FLUORINE-CONTAINING PYRAZOLE CARBOXYLIC ACID HALIDE AGC INC. (JP) 2019-06-05 EP disclosed
EP-2632901-B1 PROCESS FOR THE PREPARATION OF PYRAZOLE-4-CARBOXAMIDES SOLVAY (BE) 2018-09-12 EP disclosed
US-7781615-B2 Process for the preparation of amines SYNGENTA CROP PROTECTION, INC. (US) 2010-08-24 US disclosed
US-7781615-B2 Process for the preparation of amines SYNGENTA CROP PROTECTION, INC. (US) 2010-08-24 US disclosed
WO-2009138375-A1 PROCESS FOR THE PREPARATION OF AMIDES SYNGENTA LIMITED (GB) 2009-11-19 WO disclosed
WO-2009135860-A1 METHOD FOR MANUFACTURING ARYL CARBOXAMIDES BASF SE (DE) 2009-11-12 WO disclosed
US-20090221856-A1 PROCESS FOR THE PREPARATION OF AMINES SYNGENTA CROP PROTECTION, INC. (US) 2009-09-03 US disclosed
US-20090221856-A1 PROCESS FOR THE PREPARATION OF AMINES SYNGENTA CROP PROTECTION, INC. (US) 2009-09-03 US disclosed
EP-2076123-A1 PROCESS FOR THE PRODUCTION OF SUBSTITUTED BROMOBENZENES Syngenta Limited (GB) 2009-07-08 EP disclosed
EP-2066617-A1 PROCESS FOR THE PRODUCTION OF AROMATIC AMINES IN THE PRESENCE OF A PALLADIUM COMPLEX COMPRISING A FERROCENYL BIPHOSPHINE LIGAND Syngeta Participations AG (CH) 2009-06-10 EP disclosed
WO-2008049507-A1 PROCESS FOR THE PRODUCTION OF SUBSTITUTED BROMOBENZENES SYNGENTA LIMITED (GB) 2008-05-02 WO disclosed
WO-2008017443-A1 PROCESS FOR THE PRODUCTION OF AROMATIC AMINES IN THE PRESENCE OF A PALLADIUM COMPLEX COMPRISING A FERROCENYL BIPHOSPHINE LIGAND SYNGENTA PARTICIPATIONS AG (CH) 2008-02-14 WO 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 (3 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-20190225585-A1 METHOD OF PRODUCING FLUORINE-CONTAINING PYRAZOLE CARBOXYLIC ACID HALIDE AFF1, CYP2F1, AFF2 PNMT 4255/4885SIGMAR1 65/4885GID4 4577/4885
US-20200181091-A1 PRODUCTION METHOD FOR PYRAZOLE-4-CARBOXAMIDE DERIVATIVE AADAC, CYP3A4, ABAT PNMT 147/4885SIGMAR1 2557/4885GID4 1508/4885
US-20090221856-A1 PROCESS FOR THE PREPARATION OF AMINES HRH3, PAH, C1R PNMT 200/4885SIGMAR1 899/4885GID4 3574/4885

“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.