SCHEMBL23249646

SCHEMBL23249646

O=C(O)c1cc(Br)nn1-c1ncccc1Cl.[NaH]

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 3/20 0.41
MALT1 Q9UDY8 3/20 0.38
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TRPA1 O75762 2/20 0.36
MYC P01106 1/20 0.35
PKM P14618 1/20 0.35
RARG P13631 1/20 0.34
RORC P51449 1/20 0.34

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
SCHEMBL29361008 0.99 DHODH (0.41) DHODHMALT1LMNASMN1; SMN2TRPA1
SCHEMBL535475 0.99 DHODH (0.41) DHODHMALT1LMNASMN1; SMN2TRPA1
Hydrochloric Acid SCHEMBL23754596 0.97 DHODH (0.41) DHODHMALT1LMNASMN1; SMN2TRPA1
Toluene SCHEMBL28941923 0.91 DHODH (0.44) DHODHMALT1MYCPKM
SCHEMBL29918540 0.88 DHODH (0.41) DHODHMALT1TRPA1
SCHEMBL29558178 0.88 DHODH (0.41) DHODHMALT1TRPA1
SCHEMBL590879 0.88 DHODH (0.41) DHODHMALT1TRPA1
SCHEMBL29145342 0.87 DHODH (0.38) DHODHMALT1MYC
SCHEMBL590438 0.86 DHODH (0.41) DHODHMALT1TRPA1
SCHEMBL29563830 0.86 SCN9A (0.41) DHODHMALT1SMN1; SMN2TRPA1

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240132462-A1 METHOD FOR PREPARING TERT-BUTYL N-((1R,2S,5S)-2-((2-((5-CHLOROPYRIDIN-2-YL)AMINO)-2-OXOACETYL)AMINO)-5-(DIMETHYLCARBAMOYL)CYCLOHEXYL)CARBAMATE FMC IP TECHNOLOGY GMBH (CH) 2024-04-25 US disclosed
EP-4043451-B1 METHODS FOR THE PREPARATION OF AN INTERMEDIATE IN THE SYNTHESIS OF 5-BROMO-2-(3-CHLORO-PYRIDIN-2-YL)-2H-PYRAZOLE-3-CARBOXYLIC ACID FMC CORP (US) 2024-02-28 EP disclosed
EP-4284794-A1 METHOD FOR PREPARING TERT-BUTYL N-((1R,2S,5S)-2-((2-((5-CHLOROPYRIDIN-2-YL)AMINO)-2-OXOACETYL)AMINO)-5-(DIMETHYLCARBAMOYL)CYCLOHEXYL)CARBAMATE FMC Corporation (US) 2023-12-06 EP disclosed
EP-4253380-A2 METHODS FOR THE PREPARATION OF 5-BROMO-2-(3-CHLORO-PYRIDIN-2-YL)-2H-PYRAZOLE-3-CARBOXYLIC ACID FMC Corporation (US) 2023-10-04 EP disclosed
CN-116724033-A Method for preparing tert-butyl N- ((1R, 2S, 5S) -2- ((2- ((5-chloropyridin-2-yl) amino) -2-oxoacetyl) amino) -5- (dimethylcarbamoyl) cyclohexyl) carbamate FMC公司 2023-09-08 CN disclosed
EP-4219455-A1 METHODS FOR THE PREPARATION OF A HALOGENATED PYRAZOLE FMC Corporation (US) 2023-08-02 EP disclosed
EP-3976589-B1 METHODS FOR THE PREPARATION OF 5-BROMO-2-(3-CHLORO-PYRIDIN-2-YL)-2H-PYRAZOLE-3-CARBOXYLIC ACID FMC CORP (US) 2023-04-12 EP disclosed
US-20220396560-A1 METHODS FOR THE PREPARATION OF 5-BROMO-2-(3-CHLORO-PYRIDIN-2-YL)-2H-PYRAZOLE-3-CARBOXYLIC ACID FMC IP TECHNOLOGY GMBH (CH) 2022-12-15 US disclosed
US-20220259178-A1 METHODS FOR THE PREPARATION OF 5-BROMO-2-(3-CHLORO-PYRIDIN-2-YL)-2H-PYRAZOLE-3-CARBOXYLIC ACID FMC IP TECHNOLOGY GMBH (CH) 2022-08-18 US disclosed
CN-114650987-A Process for the preparation of 5-bromo-2- (3-chloro-pyridin-2-yl) -2H-pyrazole-3-carboxylic acid FMC公司 2022-06-21 CN disclosed
CN-114641471-A Process for the preparation of 5-bromo-2- (3-chloro-pyridin-2-yl) -2H-pyrazole-3-carboxylic acid FMC公司 2022-06-17 CN disclosed
WO-2021076835-A1 METHODS FOR THE PREPARATION OF 5-BROMO-2-(3CHLORO-PYRIDIN-2-YL)-2H-PYRAZOLE-3-CARBOXYLIC ACID FMC CORPORATION (US) 2021-04-22 WO disclosed
WO-2021076839-A1 METHODS FOR THE PREPARATION OF 5-BROMO-2-(3-CHLORO-PYRIDIN-2-YL)-2H-PYRAZOLE-3-CARBOXYLIC ACID FMC CORPORATION (US) 2021-04-22 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-20240132462-A1 METHOD FOR PREPARING TERT-BUTYL N-((1R,2S,5S)-2-((2-((5-CHLOROPYRIDIN-2-YL)AMINO)-2-OXOACETYL)AMINO)-5-(DIMETHYLCARBAMOYL)CYCLOHEXYL)CARBAMATE CPS1, TERT, PRMT5 DHODH 939/4885MALT1 1546/4885LMNA 1489/4885
US-20220259178-A1 METHODS FOR THE PREPARATION OF 5-BROMO-2-(3-CHLORO-PYRIDIN-2-YL)-2H-PYRAZOLE-3-CARBOXYLIC ACID KYAT3, PDXK, CBR3 DHODH 257/4885MALT1 3604/4885LMNA 2322/4885
US-20220396560-A1 METHODS FOR THE PREPARATION OF 5-BROMO-2-(3-CHLORO-PYRIDIN-2-YL)-2H-PYRAZOLE-3-CARBOXYLIC ACID KYAT3, PDXK, CBR3 DHODH 257/4885MALT1 3604/4885LMNA 2322/4885

“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.