SCHEMBL17248446

SCHEMBL17248446

c1cc(-c2ccc3sc4ccccc4c3c2)cc(-c2ccc3c(c2)c2ccccc2n3-c2cccc3sc4ccccc4c23)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.35
ALOX5 P09917 1/20 0.33
ALDH1A1 P00352 2/20 0.32
TSPO P30536 1/20 0.32
MAPT P10636 2/20 0.31
HPGD P15428 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
PIM3 Q86V86 1/20 0.31
TNKS O95271 1/20 0.31
TNKS2 Q9H2K2 1/20 0.31
MEN1 O00255 1/20 0.31
POLB P06746 1/20 0.31
DUSP3 P51452 1/20 0.31
BLM P54132 1/20 0.31
PTPN5 P54829 1/20 0.31
KMT2A Q03164 1/20 0.31
PTPN11 Q06124 1/20 0.31
MCL1 Q07820 1/20 0.31
CTDSP1 Q9GZU7 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
SCHEMBL17248426 0.97 GPR3 (0.37) GPR3ALOX5ALDH1A1TSPOMAPT
SCHEMBL15888796 0.96 GPR3 (0.34) GPR3ALOX5ALDH1A1TSPOMAPT
SCHEMBL15888852 0.96 GPR3 (0.34) GPR3ALOX5ALDH1A1TSPOMAPT
SCHEMBL17248420 0.94 TSPO (0.37) GPR3ALOX5ALDH1A1TSPOPIM3
SCHEMBL15892281 0.94 GPR3 (0.36) GPR3ALOX5ALDH1A1TSPOMAPT
SCHEMBL15892290 0.93 TSPO (0.36) GPR3ALOX5ALDH1A1TSPOPIM3
SCHEMBL17248444 0.93 TSPO (0.36) GPR3ALOX5ALDH1A1TSPOPIM3
SCHEMBL17248441 0.92 TSPO (0.38) GPR3ALOX5ALDH1A1TSPOPIM3
SCHEMBL26511394 0.92 GPR3 (0.39) GPR3ALOX5ALDH1A1MAPTHPGD
SCHEMBL15888793 0.92 GPR3 (0.35) GPR3ALOX5ALDH1A1TSPOMAPT

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-10361378-B2 Organic electroluminescent device NIPPON STEEL CHEMICAL & MATERIAL CO., LTD. (JP) 2019-07-23 US disclosed
US-20150325796-A1 ORGANIC ELECTROLUMINESCENT DEVICE NIPPON STEEL CHEMICAL & MATERIAL CO., LTD. (JP) 2015-11-12 US disclosed
US-20150325796-A1 ORGANIC ELECTROLUMINESCENT DEVICE NIPPON STEEL CHEMICAL & MATERIAL CO., LTD. (JP) 2015-11-12 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-10361378-B2 Organic electroluminescent device ELF3, DDT, LEF1 GPR3 3910/4885ALOX5 1717/4885ALDH1A1 829/4885

“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.