SCHEMBL101668

SCHEMBL101668

Nc1cc(F)cc(F)c1N

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.48
HDAC1 Q13547 2/20 0.33
HDAC6 Q9UBN7 1/20 0.33
CA1 P00915 4/20 0.32
CA9 Q16790 4/20 0.32
CA2 P00918 3/20 0.32
CES2 O00748 1/20 0.32
CES1 P23141 1/20 0.32
PTK2 Q05397 1/20 0.32
CA3 P07451 1/20 0.31
CA12 O43570 1/20 0.30
TAAR1 Q96RJ0 1/20 0.30
ERN1 O75460 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
SCHEMBL29674864 1.00 ALDH1A1 (0.48) ALDH1A1HDAC1HDAC6CA1CA9
SCHEMBL113484 0.84 ALDH1A1 (0.48) ALDH1A1HDAC1HDAC6CA1CA9
SCHEMBL9391171 0.78 MAPT (0.43) ALDH1A1HDAC1HDAC6CA1CA9
SCHEMBL29674966 0.78 MAPT (0.43) ALDH1A1HDAC1HDAC6CA1CA9
SCHEMBL418340 0.78 MAPT (0.43) ALDH1A1HDAC1HDAC6CA1CA9
SCHEMBL114114 0.77 ALDH1A1 (0.48) ALDH1A1HDAC1CA1CA9CA2
SCHEMBL9154640 0.74 ALDH1A1 (0.46) ALDH1A1HDAC1CA1CA9CA2
SCHEMBL231997 0.72 CA1 (0.39) ALDH1A1HDAC1HDAC6CA1CA9
SCHEMBL104581 0.72 ERN1 (0.46) ALDH1A1HDAC1CA1CA9CES2
SCHEMBL21118245 0.72 ALDH1A1 (0.33) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114805805-B Polyimide with high adhesive strength and preparation method and application thereof 深圳先进电子材料国际创新研究院 2023-12-19 CN claimed
CN-114805805-A Polyimide with high bonding strength and preparation method and application thereof 中国科学院深圳先进技术研究院 2022-07-29 CN claimed
CN-114573805-A Preparation method of high-barrier transparent flame-retardant copolymerized nylon 浙江恒逸石化研究院有限公司 2022-06-03 CN claimed
US-12492185-B2 Benzimidazole derivatives and their uses TEIJIN PHARMA LIMITED (JP) 2025-12-09 US disclosed
EP-3952866-B1 BENZIMIDAZOLE DERIVATIVES AND THEIR USES TEIJIN PHARMA LTD (JP) 2025-07-23 EP disclosed
WO-2025021868-A1 TRAF2 INHIBITORS FOR THE TREATMENT OF CANCER AND OTHER DISEASES Helmholtz Zentrum München - Deutsches Forschungszentrum für Gesundheit und Umwelt (GmbH) (DE) 2025-01-30 WO disclosed
EP-3697410-B1 BENZIMIDAZOLE DERIVATIVES AND THEIR USES TEIJIN PHARMA LTD (JP) 2024-12-18 EP disclosed
CN-115960352-B Photosensitive polyimide precursor resin, preparation method thereof and photosensitive resin composition 深圳市道尔顿电子材料股份有限公司 2024-07-05 CN disclosed
CN-118108680-A Preparation method and application of alkyl sulfonyl benzimidazole compound 广东方中高新材料有限公司 2024-05-31 CN disclosed
US-20240158385-A1 NOVEL COMPOUNDS Cerevance, Inc. 2024-05-16 US disclosed
CN-114096247-B Benzimidazole derivatives and uses thereof 帝人制药株式会社 2024-04-26 CN disclosed
US-6627645-B2 Cholinergic agents ACADIA PHARMACEUTICALS, INC. 2003-09-30 US disclosed
EP-1305308-A1 AMINOPIPERIDINE QUINOLINES AND THEIR AZAISOSTERIC ANALOGUES WITH ANTIBACTERIAL ACTIVITY SMITHKLINE BEECHAM PLC (GB) 2003-05-02 EP disclosed
EP-1278741-A1 MUSCARINIC AGONISTS Acadia Pharmaceuticals Inc. (US) 2003-01-29 EP disclosed
US-20020132842-A1 Substituted benzimidazoles, processes for their preparation, their use as medicaments, and medicaments comprising them SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2002-09-19 US disclosed
US-20020037886-A1 Muscarinic agonists ACADIA PHARMACEUTICALS INC. 2002-03-28 US disclosed
WO-2002008224-A1 AMINOPIPERIDINE QUINOLINES AND THEIR AZAISOSTERIC ANALOGUES WITH ANTIBACTERIAL ACTIVITY SMITHKLINE BEECHAM P.L.C. (GB) 2002-01-31 WO disclosed
WO-2001083472-A1 MUSCARINIC AGONISTS ACADIA PHARMACEUTICALS, INC. (US) 2001-11-08 WO disclosed
EP-1117651-A1 NEW BIS-BENZIMIDAZOLES Bayer Aktiengesellschaft (DE) 2001-07-25 EP disclosed
WO-2000020401-A1 NEW BIS-BENZIMIDAZOLES BAYER AKTIENGESELLSCHAFT (DE) 2000-04-13 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 (4 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-12492185-B2 Benzimidazole derivatives and their uses TRPC6, TRPC4, TRPC3 ALDH1A1 1414/4885HDAC1 1395/4885HDAC6 152/4885
US-20240158385-A1 NOVEL COMPOUNDS KCNK3, KCNA4, KCNK13 ALDH1A1 2143/4885HDAC1 1304/4885HDAC6 2149/4885
US-20020037886-A1 Muscarinic agonists CHRM2, CHRM1, CHRM4 ALDH1A1 1654/4885HDAC1 1231/4885HDAC6 2364/4885
US-20020132842-A1 Substituted benzimidazoles, processes for their preparation, their use as medicaments, and medicaments comprising them ABCB11, ATP1A2, ATP1A1 ALDH1A1 426/4885HDAC1 770/4885HDAC6 520/4885

“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.