SCHEMBL193707

SCHEMBL193707

N#CC1(Nc2ccc(I)cc2)CCCCC1

nearest known ligand 0.71

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.71
GAA P10253 2/20 0.64
PDE4A P27815 14/20 0.44
SMN1; SMN2 Q16637 1/20 0.39
PDE7A Q13946 4/20 0.39
ALDH1A1 P00352 1/20 0.37
POLB P06746 1/20 0.37

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
SCHEMBL3409415 0.98 CYP1A2 (0.73) CYP1A2GAAPDE4ASMN1; SMN2PDE7A
SCHEMBL185651 0.82 CYP1A2 (0.71) CYP1A2GAAPDE4APDE7AALDH1A1
SCHEMBL20340406 0.82 CYP1A2 (0.71) CYP1A2GAAPDE4ASMN1; SMN2PDE7A
SCHEMBL15647965 0.82 CYP1A2 (0.71) CYP1A2GAAPDE4ASMN1; SMN2PDE7A
SCHEMBL27003065 0.82 CYP1A2 (0.71) CYP1A2GAAPDE4ASMN1; SMN2PDE7A
SCHEMBL2534556 0.81 CYP1A2 (0.70) CYP1A2GAAPDE4ASMN1; SMN2PDE7A
SCHEMBL1715548 0.80 CYP1A2 (0.73) CYP1A2GAAPDE4ASMN1; SMN2PDE7A
SCHEMBL2538688 0.79 CYP1A2 (0.72) CYP1A2GAAPDE4ASMN1; SMN2PDE7A
SCHEMBL18961812 0.78 GAA (1.00) CYP1A2GAAPDE4APDE7AALDH1A1
SCHEMBL2126554 0.76 CYP1A2 (0.68) CYP1A2GAAPDE4ASMN1; SMN2PDE7A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8420682-B2 N-phenylacetamide derivatives, which inhibit the enzyme SOAT-1, and pharmaceutical and cosmetic compositions containing them GALDERMA RESEARCH & DEVELOPMENT (FR) 2013-04-16 US disclosed
US-20120021017-A1 N-PHENYLACETAMIDE DERIVATIVES, WHICH INHIBIT THE ENZYME SOAT-1, AND PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING THEM GALDERMA RESEARCH & DEVELOPMENT (FR) 2012-01-26 US disclosed
EP-2401259-A1 NOVEL N-PHENYLACETAMIDE DERIVATIVES, WHICH INHIBIT THE ENZYME SOAT-1, AND PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING THEM Galderma Research & Development (FR) 2012-01-04 EP disclosed
WO-2010097464-A1 NOVEL N-PHENYLACETAMIDE DERIVATIVES, WHICH INHIBIT THE ENZYME SOAT-1, AND PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING THEM GALDERMA RESEARCH & DEVELOPMENT (FR) 2010-09-02 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-20120021017-A1 N-PHENYLACETAMIDE DERIVATIVES, WHICH INHIBIT THE ENZYME SOAT-1, AND PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING THEM SOAT1, SOAT2, NAT1 CYP1A2 223/4885GAA 96/4885PDE4A 1473/4885

“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.