SCHEMBL29674875

SCHEMBL29674875

Nc1c(F)ccc(F)c1N

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
CA3 P07451 1/20 0.32
CA6 P23280 1/20 0.32
CA5A P35218 1/20 0.32
CA9 Q16790 1/20 0.32
CA14 Q9ULX7 1/20 0.32
CA5B Q9Y2D0 1/20 0.32
TAAR1 Q96RJ0 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
SCHEMBL5507464 1.00 ALDH1A1 (0.38) ALDH1A1MEN1MAPTKMT2ACA3
SCHEMBL111957 0.82 CES2 (0.36) ALDH1A1
SCHEMBL5506924 0.82 ALDH1A1 (0.33) ALDH1A1MAPT
SCHEMBL31414602 0.82 CA1 (0.40) MAPTCA3CA6CA5ACA9
SCHEMBL19000144 0.82 CA1 (0.40) MAPTCA3CA6CA5ACA9
SCHEMBL18341100 0.82 TSHR (0.40) ALDH1A1MEN1MAPTKMT2ACA9
SCHEMBL3670713 0.82 POLB (0.46) ALDH1A1MEN1MAPTKMT2A
SCHEMBL113475 0.77
SCHEMBL102976 0.77 ERN1 (0.39) ALDH1A1CA3CA6CA5ACA9
SCHEMBL2777071 0.77 TNF (0.38) ALDH1A1CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122036621-A Fluorine substituted benzimidazolyl aniline compound and synthetic method and application thereof 中茂绿能科技(西安)有限公司 2026-05-15 CN disclosed
CN-111344287-B Novel substituted biaryl compounds as indoleamine 2, 3-dioxygenase (IDO) inhibitors 默沙东有限责任公司 2023-12-19 CN disclosed
CN-116981665-A Novel compounds 思瑞万斯公司 2023-10-31 CN disclosed
US-11772085-B2 Far superior oxidation catalysts based on macrocyclic compounds CARNEGIE MELLON UNIVERSITY (US) 2023-10-03 US disclosed
CN-111601799-B Fused imidazole derivatives as Il-17 modulators UCB生物制药有限责任公司 2023-06-09 CN disclosed
EP-4015511-A1 OXIDATION CATALYSTS BASED ON MACROCYCLIC COMPOUNDS CARNEGIE MELLON UNIVERSITY (US) 2022-06-22 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-11772085-B2 Far superior oxidation catalysts based on macrocyclic compounds SOD1, ME3, ME2 ALDH1A1 1499/4885MEN1 848/4885MAPT 4625/4885

“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.