SCHEMBL8232426

SCHEMBL8232426

Bc1ccc(OC)c(C)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 1/20 0.46
▸ MAPT P10636 2/20 0.44
▸ ALOX15 P16050 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ CA2 P00918 2/20 0.41
▸ CA12 O43570 1/20 0.41
▸ CA1 P00915 1/20 0.41
▸ CA7 P43166 1/20 0.41
▸ CA9 Q16790 1/20 0.41
▸ CA14 Q9ULX7 1/20 0.41
▸ NQO2 P16083 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ CYP19A1 P11511 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ CRHBP P24387 1/20 0.40
▸ CRHR2 Q13324 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ PDGFRB P09619 1/20 0.40
▸ PDGFRA P16234 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
SCHEMBL14029293 0.83 ACHE (0.39) ACHEMAPTALDH1A1CYP3A4CA2
SCHEMBL5237640 0.82 CA2 (0.54) ACHEALDH1A1CYP3A4CA2CA12
Water SCHEMBL27700275 0.80 CA2 (0.52) ACHEALDH1A1CYP3A4CA2CA12
SCHEMBL16302625 0.78 MAPT (0.31) ACHEMAPT
SCHEMBL29352952 0.77 ACHE (0.68) ACHEMAPTALOX15ALDH1A1CYP3A4
SCHEMBL12326161 0.77 PDGFRB (0.58) ACHEMAPTALOX15ALDH1A1CYP3A4
SCHEMBL144308 0.77 ACHE (0.68) ACHEMAPTALOX15ALDH1A1CYP3A4
SCHEMBL1809851 0.76 GAA (0.43) ACHEMAPTALOX15ALDH1A1KDM4E
SCHEMBL10212793 0.76 RAB9A (0.50) ALDH1A1LMNASMN1; SMN2PDGFRBPDGFRA
SCHEMBL14838465 0.76 ALOX15 (0.53) MAPTALOX15ALDH1A1CYP3A4CA2

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
EP-3548478-B1 PYRIMIDINE COMPOUNDS CONTAINING ACIDIC GROUPS APROS THERAPEUTICS INC (US) 2021-11-17 — — EP disclosed
US-20100331566-A1 SYNTHETIC METHODS AND COMPOSITIONS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY 2010-12-30 — — US disclosed
EP-2085399-A1 substituted arylamide oxazepinopyrimidone derivatives Sanofi-Aventis (FR) 2009-08-05 — — EP disclosed
WO-2008155669-A2 ARYLAMIDE PYRIMIDONE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SANOFI-AVENTIS (FR) 2008-12-24 — — WO disclosed
EP-1992620-A1 Arylamide pyrimidone derivatives for the treatment of neurodegenerative diseases Sanofi-Aventis (FR) 2008-11-19 — — EP disclosed
WO-2007057790-A2 SUBSTITUTED BICYCLIC PYRIMIDONE DERIVATIVES SANOFI-AVENTIS (FR) 2007-05-24 — — 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 (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-20100331566-A1 SYNTHETIC METHODS AND COMPOSITIONS ABL1, BICRA, BRD4 ACHE 2044/4885MAPT 3364/4885ALOX15 3857/4885

“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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