SCHEMBL10054537

SCHEMBL10054537

Cc1cc2sc3cc(Br)sc3c2s1

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
GPR35 Q9HC97 1/20 0.31

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
SCHEMBL1697388 0.85 GPR35 (0.39) GPR35
SCHEMBL120586 0.85 PKM (0.50) PKMNPSR1RXFP1GPR35
SCHEMBL14227567 0.78 ALDH1A1 (0.34) PKMNPSR1RXFP1
SCHEMBL12775257 0.78 PKM (0.48) PKMNPSR1RXFP1GPR35
SCHEMBL14468333 0.76 PKM (0.44) PKMNPSR1RXFP1GPR35
SCHEMBL12775254 0.75 PKM (0.47) PKMNPSR1RXFP1GPR35
SCHEMBL20173340 0.75 PKM (0.47) PKMNPSR1RXFP1GPR35
SCHEMBL19303385 0.74 PKM (0.42) PKMNPSR1RXFP1GPR35
SCHEMBL12415250 0.73 GPR35 (0.35) GPR35
SCHEMBL14608697 0.73 PKM (0.33) PKMNPSR1RXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8710094-B2 Quinoid thiophene organic photoelectric material, preparation method thereof and application thereof OCEAN'S KING LIGHTING SCIENCE & TECHNOLOGY CO., LTD. (CN) 2014-04-29 US disclosed
US-20120302763-A1 QUINOID THIOPHENE ORGANIC PHOTOELECTRIC MATERIAL, PREPARATION METHOD THEREOF AND APPLICATION THEREOF OCEAN'S KING LIGHTING SCIENCE & TECHNOLOGY CO., LT D, (CN) 2012-11-29 US disclosed
WO-2012002185-A1 NOVEL ORGANIC COMPOUND AND ELECTROCHROMIC DEVICE INCLUDING THE SAME CANON KABUSHIKI KAISHA (JP) 2012-01-05 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-20120302763-A1 QUINOID THIOPHENE ORGANIC PHOTOELECTRIC MATERIAL, PREPARATION METHOD THEREOF AND APPLICATION THEREOF CCNE2, CCNE1, CRY1 PKM 2644/4885NPSR1 3779/4885RXFP1 4310/4885

“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.