SCHEMBL2903444

SCHEMBL2903444

Cn1cc(C(=O)O)c(C(F)(F)Cl)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.46
POLB P06746 1/20 0.46
GAA P10253 2/20 0.43
KMT2A Q03164 1/20 0.33
STING1 Q86WV6 1/20 0.32
TEAD1 P28347 1/20 0.32
TEAD4 Q15561 1/20 0.32
TEAD2 Q15562 1/20 0.32
TEAD3 Q99594 1/20 0.32
PKM P14618 1/20 0.32
PLA2G7 Q13093 1/20 0.32
MGLL Q99685 1/20 0.32
ABHD6 Q9BV23 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
MAPK1 P28482 1/20 0.31
PSEN1 P49768 1/20 0.31
PSEN2 P49810 1/20 0.31
APH1B Q8WW43 1/20 0.31
NCSTN Q92542 1/20 0.31

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
SCHEMBL2347739 0.90 GAA (0.47) LMNAPOLBGAAKMT2ASTING1
SCHEMBL28137017 0.86 POLB (0.49) LMNAPOLBGAAKMT2ASTING1
SCHEMBL20448183 0.86 LMNA (0.46) LMNAPOLBGAASTING1MGLL
SCHEMBL19182678 0.86 GAA (0.56) LMNAPOLBGAASTING1TEAD1
SCHEMBL5720264 0.86 POLB (0.41) LMNAPOLBGAAKMT2ARAB9A
SCHEMBL353314 0.86 GAA (0.56) LMNAPOLBGAASTING1TEAD1
SCHEMBL29451179 0.85 LMNA (0.45) LMNAPOLBGAASTING1NPC1
SCHEMBL19183312 0.85 LMNA (0.45) LMNAPOLBGAASTING1NPC1
Hydrochloric Acid SCHEMBL8355477 0.84 GAA (0.55) LMNAPOLBGAASTING1TEAD1
SCHEMBL1194663 0.83 LMNA (0.46) LMNAPOLBGAASTING1TEAD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210179563-A1 PROCESS FOR THE MANUFACTURE OF IMINIUM COMPOUNDS AND THEIR APPLICATION IN THE MANUFACTURE OF PYRAZOLE DERIVATIVES SOLVAY SA (BE) 2021-06-17 US disclosed
CN-108368055-B Preparation method of 3-fluoroalkyl-1-methylpyrazole-4-carboxylic acid 宿迁市科莱博生物化学有限公司 2021-04-16 CN disclosed
EP-3728195-A1 PROCESS FOR THE MANUFACTURE OF PYRAZOLE COMPOUNDS SOLVAY SA (BE) 2020-10-28 EP disclosed
US-20200305431-A1 PROCESS FOR THE MANUFACTURE OF PYRAZOLE COMPOUNDS SOLVAY SA (BE) 2020-10-01 US disclosed
CN-111587241-A Method for producing iminium compound and use thereof for producing pyrazole derivative 索尔维公司 2020-08-25 CN disclosed
CN-111587242-A Process for producing pyrazole compound 索尔维公司 2020-08-25 CN disclosed
CN-106467492-B preparation method of polyfluoromethyl pyrazole compound, intermediate and preparation method 联化科技(盐城)有限公司 2019-12-17 CN disclosed
US-10457645-B2 Method for the preparation of 3-fluoroalkyl-1-methylpyrazol-4-carboxylic acid CHANGZHOU KEYLAB BIOCHEMICAL CO., LTD. (CN) 2019-10-29 US disclosed
US-20180273486-A1 METHOD FOR THE PREPARATION OF 3-FLUOROALKYL-1-METHYLPYRAZOL-4-CARBOXYLIC ACID CHANGZHOU KEYLAB BIOCHEMICAL CO., LTD. (CN) 2018-09-27 US disclosed
EP-3357913-A1 PREPARATION METHOD FOR 3-FLUOROALKYL-1-METHYLPYRAZOLE-4-CARBOXYLIC ACID Solvay Fluor GmbH (DE) 2018-08-08 EP disclosed
EP-2671874-B1 Preparation of esters of 1-substituted-3-fluoroalkyl-pyrazole-4-carboxylic acids SOLVAY (BE) 2016-01-13 EP disclosed
US-8981116-B2 Process for the preparation of esters of 1-substituted-3-fluoroalkyl-pyrazole-4-carboxylic acids SOLVAY SA (BE) 2015-03-17 US disclosed
EP-2671874-A1 Preparation of esters of 1-substituted-3-fluoroalkyl-pyrazole-4-carboxylic acids SOLVAY SA (BE) 2013-12-11 EP disclosed
US-20130123510-A1 Process for the preparation of esters of 1-substituted-3-fluoroalkyl-pyrazole-4-carboxylic acids SOLVAY SA (BE) 2013-05-16 US disclosed
CN-103068805-A Preparation method of 1-substituted-3-fluoroalkyl-pyrazole-4-carboxylic ester SOLVAY 2013-04-24 CN disclosed
US-20100305124-A1 Acylated Aminopyridine and Aminopyridazine Insecticides BAYER CROPSCIENCE AG (DE) 2010-12-02 US disclosed
EP-2236505-A1 Acylated aminopyridines and pyridazines as insecticides Bayer CropScience AG (DE) 2010-10-06 EP disclosed
EP-0623113-B1 PYRAZOLE CARBOXANILIDE FUNGICIDES MONSANTO CO (US) 1997-03-05 EP disclosed
US-5223526-A For plants MONSANTO COMPANY (US) 1993-06-29 US disclosed
WO-1993011117-A1 PYRAZOLE CARBOXANILIDE FUNGICIDES MONSANTO COMPANY (US) 1993-06-10 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 (6 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-20200305431-A1 PROCESS FOR THE MANUFACTURE OF PYRAZOLE COMPOUNDS CYP3A4, CYP3A43, CYP2E1 LMNA 3401/4885POLB 2554/4885GAA 1946/4885
US-10457645-B2 Method for the preparation of 3-fluoroalkyl-1-methylpyrazol-4-carboxylic acid PFAS, KCNK5, PCCA LMNA 2675/4885POLB 2201/4885GAA 3562/4885
US-20180273486-A1 METHOD FOR THE PREPARATION OF 3-FLUOROALKYL-1-METHYLPYRAZOL-4-CARBOXYLIC ACID PFAS, KCNK5, PCCA LMNA 2675/4885POLB 2201/4885GAA 3562/4885
US-20130123510-A1 Process for the preparation of esters of 1-substituted-3-fluoroalkyl-pyrazole-4-carboxylic acids CYP2F1, KHK, CYP4F3 LMNA 1953/4885POLB 2256/4885GAA 1327/4885
US-20100305124-A1 Acylated Aminopyridine and Aminopyridazine Insecticides AAAS, DDT, QDPR LMNA 2262/4885POLB 2949/4885GAA 2373/4885
US-20210179563-A1 PROCESS FOR THE MANUFACTURE OF IMINIUM COMPOUNDS AND THEIR APPLICATION IN THE MANUFACTURE OF PYRAZOLE DERIVATIVES CYP3A5, CYP3A4, CYP3A43 LMNA 3744/4885POLB 2576/4885GAA 2348/4885

“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.