SCHEMBL14713494

SCHEMBL14713494

Cc1ccc(N(c2ccc(C)cc2)c2ccc(C3=CC=CC3)cc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
TSHR P16473 1/20 0.35
NISCH Q9Y2I1 2/20 0.33

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
SCHEMBL2836934 0.88 ACHE (0.38) ALDH1A1NISCH
SCHEMBL1116107 0.86 ACHE (0.36) NISCH
SCHEMBL13712586 0.79 ALDH1A1 (0.39) ALDH1A1TSHRNISCH
SCHEMBL3365487 0.76 ALDH1A1 (0.31) ALDH1A1TSHR
SCHEMBL8927323 0.75 ALDH1A1 (0.52) ALDH1A1TSHRNISCH
SCHEMBL16406860 0.75 ALDH1A1 (0.52) ALDH1A1TSHRNISCH
SCHEMBL174956 0.75 ALDH1A1 (0.52) ALDH1A1TSHRNISCH
SCHEMBL17409158 0.75 ALDH1A1 (0.52) ALDH1A1TSHRNISCH
SCHEMBL17358866 0.75 ALDH1A1 (0.52) ALDH1A1TSHRNISCH
SCHEMBL6950285 0.75 ALDH1A1 (0.52) ALDH1A1TSHRNISCH

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-20130042918-A1 OLIGOTHIOPHENES COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARIAL ORGANISATION 2013-02-21 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-20130042918-A1 OLIGOTHIOPHENES NR0B2, NR2C2, NR1H2 ALDH1A1 1604/4885TSHR 63/4885NISCH 3480/4885

“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.