SCHEMBL348846

SCHEMBL348846

Brc1ccc2sc3c(sc4c5ccccc5sc43)c2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.41
EGFR P00533 1/20 0.40
IDO1 P14902 1/20 0.39
PTPN1 P18031 2/20 0.39
EPM2A O95278 1/20 0.39
PTPN2 P17706 1/20 0.39
PTPN22 Q9Y2R2 1/20 0.39
TDO2 P48775 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
MAPT P10636 4/20 0.37
RAB9A P51151 3/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
KDM4E B2RXH2 2/20 0.36
NPC1 O15118 1/20 0.36
PIM1 P11309 2/20 0.35
PIM2 Q9P1W9 2/20 0.35
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL17037082 0.96 GPR3 (0.44) GPR3EGFRIDO1PTPN1EPM2A
SCHEMBL9949673 0.86 CYP2A6 (0.42) IDO1PTPN1EPM2APTPN2PTPN22
SCHEMBL29499025 0.85 MAPT (0.46) GPR3EGFRIDO1PTPN1PTPN2
SCHEMBL17037087 0.85 MAPT (0.46) GPR3EGFRIDO1PTPN1PTPN2
SCHEMBL17037081 0.82 EPM2A (0.38) IDO1PTPN1EPM2APTPN2PTPN22
SCHEMBL23917094 0.82 GPR3 (0.50) GPR3PTPN1PTPN2MAPTRAB9A
SCHEMBL349784 0.82 GPR3 (0.60) GPR3PTPN1PTPN2MAPTRAB9A
SCHEMBL29536667 0.80 GPR3 (0.61) GPR3IDO1PTPN1EPM2APTPN2
SCHEMBL26685 0.80 GPR3 (0.61) GPR3IDO1PTPN1EPM2APTPN2
SCHEMBL19110405 0.80 PTPN1 (0.46) GPR3EGFRIDO1PTPN1EPM2A

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-8350256-B2 Organic semiconductor compounds INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2013-01-08 US disclosed
US-20120012819-A1 ORGANIC SEMICONDUCTOR COMPOUNDS INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2012-01-19 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-20120012819-A1 ORGANIC SEMICONDUCTOR COMPOUNDS TST, TPST2, BHMT2 GPR3 3305/4885EGFR 3330/4885IDO1 1012/4885

“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.