SCHEMBL16166183

SCHEMBL16166183

CC(=O)c1nc(Cl)ccc1F

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
PTGS2 P35354 2/20 0.37
KMT2A Q03164 3/20 0.35
GAA P10253 2/20 0.35
MEN1 O00255 1/20 0.35
KCNQ3 O43525 2/20 0.33
KCNQ2 O43526 2/20 0.33
KCNE1 P15382 2/20 0.33
KCNQ1 P51787 2/20 0.33
ABL1 P00519 1/20 0.33
RAB9A P51151 1/20 0.33
ADORA2A P29274 1/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
KEAP1 Q14145 1/20 0.32
NFE2L2 Q16236 1/20 0.32

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
SCHEMBL31306012 1.00 ALDH1A1 (0.37) ALDH1A1LMNAMAPTPTGS2KMT2A
SCHEMBL29202700 0.82 ALDH1A1 (0.38) ALDH1A1LMNAKMT2AGAAMEN1
SCHEMBL1760173 0.82 KEAP1 (0.41) ALDH1A1MAPTKMT2AGAAMEN1
SCHEMBL16176006 0.80 CASP3 (0.33)
SCHEMBL15651124 0.80 IKBKB (0.40) ALDH1A1LMNAKMT2AGAAMEN1
SCHEMBL24859645 0.79 TSHR (0.41) ALDH1A1MAPTKMT2AGAAMEN1
SCHEMBL30054378 0.79 NPSR1 (0.47) ALDH1A1LMNAMAPTKMT2AGAA
SCHEMBL2894142 0.79 NPSR1 (0.47) ALDH1A1LMNAMAPTKMT2AGAA
SCHEMBL18412839 0.79 GAA (0.42) ALDH1A1LMNAMAPTKMT2AGAA
SCHEMBL18498680 0.79 CTSA (0.40) PTGS2KMT2AGAAMEN1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250326770-A1 BENZOTRIAZOLE COMPOUND DAIICHI SANKYO COMPANY, LIMITED (JP) 2025-10-23 US disclosed
EP-4618974-A1 OREXIN RECEPTOR AGONISTS Merck Sharp & Dohme LLC (US) 2025-09-24 EP disclosed
US-20250282724-A1 BENZOTRIAZOLE COMPOUND DAIICHI SANKYO COMPANY, LIMITED (JP) 2025-09-11 US disclosed
US-12378260-B2 Benzotriazole compound DAIICHI SANKYO COMPANY, LIMITED (JP) 2025-08-05 US disclosed
US-20250092064-A1 BENZOTRIAZOLE COMPOUND DAIICHI SANKYO COMPANY, LIMITED (JP) 2025-03-20 US disclosed
EP-4509504-A1 BENZOTRIAZOLE COMPOUND Daiichi Sankyo Company, Limited (JP) 2025-02-19 EP disclosed
WO-2024107615-A1 OREXIN RECEPTOR AGONISTS MERCK SHARP & DOHME LLC (US) 2024-05-23 WO disclosed
WO-2024107615-A1 OREXIN RECEPTOR AGONISTS MERCK SHARP & DOHME LLC (US) 2024-05-23 WO disclosed
WO-2023210741-A1 BENZOTRIAZOLE COMPOUND 第一三共株式会社 2023-11-02 WO disclosed
US-11447478-B2 BACE1 inhibitors HOFFMANN-LA ROCHE INC. (US) 2022-09-20 US disclosed
US-9957281-B2 Benzodiazepine derivatives as RSV inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2018-05-01 US disclosed
US-20170022221-A1 BENZODIAZEPINE DERIVATIVES AS RSV INHIBITORS ENANTA PHARMACEUTICALS, INC. 2017-01-26 US disclosed
US-20160052920-A1 BACE1 INHIBITORS HOFFMANN-LA ROCHE INC. (US) 2016-02-25 US disclosed
EP-2984086-A1 BACE1 INHIBITORS F. Hoffmann-La Roche AG (CH) 2016-02-17 EP disclosed
WO-2014166906-A1 BACE1 INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2014-10-16 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 (7 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-20160052920-A1 BACE1 INHIBITORS BACE1, BACE2, APP ALDH1A1 701/4885LMNA 1177/4885MAPT 27/4885
US-11447478-B2 BACE1 inhibitors BACE1, BACE2, APP ALDH1A1 701/4885LMNA 1177/4885MAPT 27/4885
US-20250092064-A1 BENZOTRIAZOLE COMPOUND NFE2L2, BPTF, KEAP1 ALDH1A1 416/4885LMNA 2933/4885MAPT 245/4885
US-12378260-B2 Benzotriazole compound NFE2L2, BPTF, KEAP1 ALDH1A1 416/4885LMNA 2933/4885MAPT 245/4885
US-20170022221-A1 BENZODIAZEPINE DERIVATIVES AS RSV INHIBITORS GABRA5, GABRA1, GABBR2 ALDH1A1 621/4885LMNA 2153/4885MAPT 2157/4885
US-20250326770-A1 BENZOTRIAZOLE COMPOUND KEAP1, NFE2L2, TXNRD2 ALDH1A1 588/4885LMNA 2817/4885MAPT 169/4885
US-20250282724-A1 BENZOTRIAZOLE COMPOUND NFE2L2, BPTF, KEAP1 ALDH1A1 416/4885LMNA 2933/4885MAPT 245/4885

“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.