SCHEMBL415930

SCHEMBL415930

Nc1cc(F)cc(C(=O)O)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR1 Q9BXC0 1/20 0.59
LDHA P00338 1/20 0.51
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 2/20 0.47
LMNA P02545 2/20 0.47
HCAR2 Q8TDS4 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
DDO Q99489 1/20 0.47
CES2 O00748 2/20 0.46
CES1 P23141 2/20 0.46
TPMT P51580 3/20 0.44
CA12 O43570 2/20 0.41
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA7 P43166 2/20 0.41
CA9 Q16790 2/20 0.41
CA14 Q9ULX7 2/20 0.41
KEAP1 Q14145 1/20 0.41
BCL2L1 Q07817 1/20 0.40

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
SCHEMBL8999884 0.84 CES2 (0.48) HCAR1LDHAKDM4EALDH1A1LMNA
SCHEMBL109155 0.83 KDM4E (0.56) HCAR1KDM4EALDH1A1LMNAMEN1
SCHEMBL336433 0.83 HCAR1 (0.73) HCAR1KDM4EALDH1A1LMNAHCAR2
SCHEMBL157714 0.83 HCAR1 (0.73) HCAR1KDM4EALDH1A1LMNAHCAR2
SCHEMBL2820215 0.83 KDM4E (0.56) KDM4EALDH1A1LMNAMEN1KMT2A
SCHEMBL223304 0.83 KDM4E (0.56) KDM4EALDH1A1LMNAMEN1KMT2A
SCHEMBL3090976 0.82 PARP1 (0.52) HCAR1LDHAKDM4EHCAR2CES2
SCHEMBL2888306 0.80 KDM4E (0.54) HCAR1KDM4EALDH1A1LMNAMEN1
SCHEMBL1478628 0.80 KDM4E (0.54) HCAR1KDM4EALDH1A1LMNAMEN1
Hydrochloric Acid SCHEMBL8653192 0.80 KDM4E (0.54) KDM4EALDH1A1LMNAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117800914-B Anti-SARS-CoV-2 virus armstrong mutant inhibitor 中国人民解放军海军军医大学 2026-05-19 CN claimed
CN-113174241-B Graphene synergistic heat storage composite material and preparation method and application thereof 山西大同大学 2022-04-08 CN claimed
CN-113174241-A Graphene synergistic heat storage composite material and preparation method and application thereof 山西大同大学 2021-07-27 CN claimed
CN-106831792-A A kind of preparation method of PARP inhibitor Rucaparib intermediates 青岛辰达生物科技有限公司 2017-06-13 CN claimed
CN-106748958-A A kind of preparation method of Rucaparib intermediates 青岛辰达生物科技有限公司 2017-05-31 CN claimed
EP-1973883-B1 NOVEL COMPOUNDS AND METHODS FOR THEIR PRODUCTION BRISTOL MYERS SQUIBB CO (US) 2012-07-11 EP claimed
US-20110021481-A1 Novel Compounds and Methods for Their Production BRISTOL-MYERS SQUIBB COMPANY 2011-01-27 US claimed
CN-101578268-A Novel compounds and methods for their production BIOTICA TECH LTD (GB) 2009-11-11 CN claimed
US-20090253667-A1 18 ,21-Didesoxymacbecin Derivatives for the Treatment of Cancer BIOTICA TECHNOLOGY LIMITED (GB) 2009-10-08 US claimed
CN-101460465-A 18,21-didesoxymacbecin derivatives for the treatment of cancer BIOTICA TECH LTD (GB) 2009-06-17 CN claimed
EP-1973883-A2 NOVEL COMPOUNDS AND METHODS FOR THEIR PRODUCTION Biotica Technology Limited (GB) 2008-10-01 EP claimed
EP-1928837-A2 18,21-DIDESOXYMACBECIN DERIVATIVES FOR THE TREATMENT OF CANCER Biotica Technology Limited (GB) 2008-06-11 EP claimed
WO-2008056188-A2 NOVEL COMPOUNDS AND METHODS FOR THEIR PRODUCTION BIOTICA TECHNOLOGY LIMITED (GB) 2008-05-15 WO claimed
WO-2007128829-A2 18,21-DIDESOXYMACBECIN DERIVATIVES FOR THE TREATMENT OF CANCER BIOTICA TECHNOLOGY LIMITED (GB) 2007-11-15 WO claimed
US-20260144743-A1 COMPOUNDS TMEM16A LIMITED (GB) 2026-05-28 US disclosed
CN-117800914-B Anti-SARS-CoV-2 virus armstrong mutant inhibitor 中国人民解放军海军军医大学 2026-05-19 CN disclosed
CN-116323601-B 2- (3-Pyridin-2-yl-4-quinolin-4-yl-pyrazol-1-yl) -acetamide derivatives as transforming growth factor-beta receptor I/ALK5 inhibitors 阿戈麦布西班牙股份有限公司 2026-05-12 CN disclosed
EP-0831845-A4 DIPHOSPHONATE DERIVATIVES OF THERAPEUTIC AGENTS ELIZANOR BIOPHARMACEUTICALS IN (US) 1998-12-02 EP disclosed
EP-0831845-A1 DIPHOSPHONATE DERIVATIVES OF THERAPEUTIC AGENTS Elizanor Biopharmaceuticals, Inc. (US) 1998-04-01 EP disclosed
WO-1996040156-A1 DIPHOSPHONATE DERIVATIVES OF THERAPEUTIC AGENTS ELIZANOR BIOPHARMACEUTICALS, INC. (US) 1996-12-19 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-20260144743-A1 COMPOUNDS CACNA1E, TMEM109, CACNA1C HCAR1 263/4885LDHA 2540/4885KDM4E 3794/4885
US-20090253667-A1 18 ,21-Didesoxymacbecin Derivatives for the Treatment of Cancer BCL3, BECN1, CD22 HCAR1 666/4885LDHA 4179/4885KDM4E 1367/4885
US-20110021481-A1 Novel Compounds and Methods for Their Production BCL6, BCL3, AQP4 HCAR1 1818/4885LDHA 3729/4885KDM4E 2782/4885

“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.