SCHEMBL9913669

SCHEMBL9913669

O=C(O)C1c2[nH]c3ccccc3c2CCN1C(=O)c1ccccc1

nearest known ligand 0.72

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 16/20 0.72
ABCB1 P08183 12/20 0.72
ALDH1A1 P00352 1/20 0.60
PKM P14618 1/20 0.56
LMNA P02545 1/20 0.55
TP53 P04637 1/20 0.55

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
SCHEMBL6465789 0.92 ABCG2 (0.72) ABCG2ABCB1ALDH1A1LMNATP53
SCHEMBL3712664 0.84 ABCG2 (1.00) ABCG2ABCB1LMNATP53
SCHEMBL23438776 0.80 PKM (0.53) ABCG2ABCB1ALDH1A1PKMLMNA
SCHEMBL18689299 0.79 ABCG2 (1.00) ABCG2ABCB1
SCHEMBL4264083 0.79 ABCG2 (1.00) ABCG2ABCB1LMNA
SCHEMBL13912132 0.79 ABCG2 (1.00) ABCG2ABCB1LMNATP53
SCHEMBL1491468 0.79 ABCG2 (0.50) ABCG2ABCB1PKMLMNATP53
SCHEMBL13912108 0.77 ABCG2 (0.92) ABCG2ABCB1ALDH1A1LMNA
SCHEMBL13912101 0.77 ABCG2 (0.92) ABCG2ABCB1LMNATP53
SCHEMBL13912103 0.77 ABCG2 (0.92) ABCG2ABCB1LMNATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8198447-B2 Fused tricyclic compound having aldose reductase inhibitory activity NATIONAL UNIVERSITY CORPORATION UNIVERSITY OF TOYAMA (JP) 2012-06-12 US disclosed
US-20100145052-A1 FUSED TRICYCLIC COMPOUND HAVING ALDOSE REDUCTASE INHIBITORY ACTIVITY NATIONAL UNIVERSITY CORPORATION UNIVERSITY OF TOYAMA (JP) 2010-06-10 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-20100145052-A1 FUSED TRICYCLIC COMPOUND HAVING ALDOSE REDUCTASE INHIBITORY ACTIVITY AKR1C4, AKR1C2, AKR1C3 ABCG2 833/4885ABCB1 1727/4885ALDH1A1 45/4885

“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.