SCHEMBL8340738

SCHEMBL8340738

Cc1ccc(C(=O)F)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.62
CES2 O00748 3/20 0.62
CES1 P23141 3/20 0.62
LMNA P02545 3/20 0.62
SMN1; SMN2 Q16637 3/20 0.59
HTT P42858 3/20 0.54
NPSR1 Q6W5P4 3/20 0.54
TDP1 Q9NUW8 3/20 0.54
KMT2A Q03164 3/20 0.54
PKM P14618 2/20 0.54
ATM Q13315 2/20 0.54
HPGD P15428 2/20 0.54
MEN1 O00255 2/20 0.54
NLRP1 Q9C000 1/20 0.54
GAA P10253 1/20 0.54
NTSR1 P30989 1/20 0.54
SRD5A2 P31213 1/20 0.52
HDAC1 Q13547 1/20 0.52
HDAC6 Q9UBN7 1/20 0.52
GSK3B P49841 1/20 0.50

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
SCHEMBL102601 0.85 TSHR (0.47) ALDH1A1CES2CES1LMNAHTT
SCHEMBL4209872 0.79 CES2 (0.71) ALDH1A1CES2CES1LMNASMN1; SMN2
SCHEMBL23417802 0.78 MAPT (0.54) ALDH1A1LMNASMN1; SMN2NPSR1TDP1
SCHEMBL20118491 0.77 ALDH1A1 (0.52) ALDH1A1CES2CES1LMNASMN1; SMN2
SCHEMBL167254 0.77 CES2 (1.00) ALDH1A1CES2CES1LMNASMN1; SMN2
SCHEMBL822185 0.77 ALDH1A1 (1.00) ALDH1A1CES2CES1LMNASMN1; SMN2
SCHEMBL52200 0.77 ALDH1A1 (1.00) ALDH1A1CES2CES1LMNASMN1; SMN2
SCHEMBL12212918 0.77 BCL2L1 (0.50) CES2CES1LMNASMN1; SMN2KMT2A
SCHEMBL22832292 0.77 SRD5A2 (0.55) ALDH1A1LMNAHTTTDP1KMT2A
SCHEMBL17288381 0.77 ALDH1A1 (0.52) ALDH1A1CES2CES1LMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110698404-A Preparation method of high-purity celecoxib 安徽恒星制药有限公司 2020-01-17 CN claimed
EP-4707263-A1 FLUORINATING AGENT AND FLUORINATION METHOD Daikin Industries, Ltd. (JP) 2026-03-11 EP disclosed
US-20240017996-A1 FLUORINATION PROCESSES UNIVERSITY COLLEGE LONDON (GB) 2024-01-18 US disclosed
US-20230339829-A1 FLUORINATION PROCESSES UNIVERSITY COLLEGE LONDON (GB) 2023-10-26 US disclosed
EP-3560910-B1 METHOD FOR MANUFACTURING DIFLUOROMETHYLENE COMPOUND DAIKIN IND LTD (JP) 2023-03-29 EP disclosed
CN-110114334-B Method for producing difluoromethylene compound 大金工业株式会社 2022-06-17 CN disclosed
CN-110698404-A Preparation method of high-purity celecoxib 安徽恒星制药有限公司 2020-01-17 CN disclosed
EP-2445909-B1 DERIVATIVES OF 6,7-DIHYDRO-5H-IMIDAZO[1,2-a]IMIDAZOLE-3-CARBOXYLIC ACID AMIDES BOEHRINGER INGELHEIM INT (DE) 2013-11-13 EP disclosed
EP-2308854-A1 2,3,6-trisubstituted-4-pyrimidone derivatives Sanofi-Aventis (FR) 2011-04-13 EP disclosed
EP-2305651-A1 2,3,6-trisubstituted-4-pyrimidone derivatives Mitsubishi Tanabe Pharma Corporation (JP) 2011-04-06 EP disclosed
WO-2004085408-A1 2, 3, 6-TRISUBSTITUTED-4-PYRIMIDONE DERIVATIVES MITSUBISHI PHARMA CORPORATION (JP) 2004-10-07 WO disclosed
EP-0847992-B1 Benzamide derivatives, useful as cell differentiation inducers SCHERING AG (DE) 2004-06-23 EP disclosed
US-4555370-A CYANTATION OF ACYL. FLUORIDE BAYER AKTIENGESELLSCHAFT (DE) 1985-11-26 US disclosed
EP-0038987-B1 PROCESS FOR PREPARING ACYL CYANIDES BAYER AG (DE) 1983-06-08 EP disclosed
EP-0038987-A1 Process for preparing acyl cyanides BAYER AG (DE) 1981-11-04 EP disclosed
EP-0018481-A1 Process for producing alpha, alpha, alpha-trifluoro-o-toluic fluoride NIHON NOHYAKU CO., LTD. (JP) 1980-11-12 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-20230339829-A1 FLUORINATION PROCESSES PPIP5K2, PFAS, ARFGEF1 ALDH1A1 3448/4885CES2 1518/4885CES1 3615/4885

“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.