SCHEMBL32673266

SCHEMBL32673266

Nc1c(F)cc(Cl)cc1C(=O)c1ccccc1F

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.49
▸ MAPT P10636 1/20 0.49
▸ RECQL P46063 1/20 0.47
▸ ALOX15 P16050 1/20 0.46
▸ CES2 O00748 1/20 0.44
▸ CES1 P23141 1/20 0.44
▸ RAB9A P51151 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ KCNMA1 Q12791 1/20 0.41
▸ MAPK14 Q16539 2/20 0.41
▸ FADS1 O60427 1/20 0.40
▸ KAT6A Q92794 1/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.40
▸ GRM2 Q14416 1/20 0.40
▸ TP53 P04637 1/20 0.39
▸ RORB Q92753 1/20 0.39

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
SCHEMBL17979466 0.88 CES2 (0.47) ALDH1A1MAPTRECQLALOX15CES2
SCHEMBL28003970 0.88 ALDH1A1 (0.47) ALDH1A1MAPTRECQLALOX15CES2
SCHEMBL14917063 0.84 MAPT (0.47) ALDH1A1MAPTALOX15MAPK14
SCHEMBL29858361 0.82 RECQL (0.71) ALDH1A1MAPTRECQLALOX15CES2
SCHEMBL333224 0.82 RECQL (0.71) ALDH1A1MAPTRECQLALOX15CES2
SCHEMBL29515875 0.82 RECQL (0.71) ALDH1A1MAPTRECQLALOX15CES2
SCHEMBL1342161 0.77 ALDH1A1 (0.56) ALDH1A1MAPTRECQLALOX15CES2
SCHEMBL29963527 0.77 ALDH1A1 (0.56) ALDH1A1MAPTRECQLALOX15CES2
SCHEMBL7544330 0.77 ALDH1A1 (0.48) ALDH1A1MAPTRECQLALOX15CES2
SCHEMBL2704116 0.77 ALDH1A1 (0.59) ALDH1A1MAPTRECQLALOX15CES2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260042763-A1 PERIPHERALLY RESTRICTED GABA POSITIVE ALLOSTERIC MODULATORS FOR THE TREATMENT OF IRRITABLE BOWEL SYNDROME AND OTHER AILMENTS OF THE PERIPHERAL NERVOUS SYSTEM UNIV JOHNS HOPKINS (US) 2026-02-12 — — US 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-20260042763-A1 PERIPHERALLY RESTRICTED GABA POSITIVE ALLOSTERIC MODULATORS FOR THE TREATMENT OF IRRITABLE BOWEL SYNDROME AND OTHER AILMENTS OF THE PERIPHERAL NERVOUS SYSTEM GABRB2, GABRB3, GABRB1 ALDH1A1 1600/4885MAPT 2868/4885RECQL 3227/4885

“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.

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