SCHEMBL20176176

SCHEMBL20176176

CCc1cc(C#N)sc1C(C)C

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
PTPN2 P17706 1/20 0.30

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
SCHEMBL14116672 0.84
SCHEMBL4164652 0.77 MME (0.32) PTPN2
SCHEMBL20195375 0.75 ALDH1A1 (0.36) ALDH1A1
SCHEMBL22789280 0.75 PGR (0.37)
SCHEMBL22774494 0.73 PNMT (0.30)
SCHEMBL15431065 0.73 PNMT (0.30)
SCHEMBL13540956 0.72 ALOX15 (0.32)
SCHEMBL15107088 0.72 MAPK1 (0.35) ALDH1A1
SCHEMBL20079514 0.72 ALOX15 (0.32) ALDH1A1
SCHEMBL22775240 0.70 CYP3A4 (0.32) ALDH1A1

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-20180144877-A1 PHOTOELECTRIC CONVERSION ELEMENT, SOLAR CELL, AND COMPOUND FUJIFILM CORPORATION (JP) 2018-05-24 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-20180144877-A1 PHOTOELECTRIC CONVERSION ELEMENT, SOLAR CELL, AND COMPOUND SLC9A1, SLC9A2, SLC26A3 ALDH1A1 2172/4885PTPN2 2571/4885

“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.