SCHEMBL21398960

SCHEMBL21398960

Clc1cccc2sc3c(N(c4ccccc4)c4ccc5sc6ccccc6c5c4)cccc3c12

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.33
KDM4E B2RXH2 2/20 0.33
MAPT P10636 4/20 0.32
ALDH1A1 P00352 2/20 0.32
HPGD P15428 2/20 0.32
RAB9A P51151 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
HCRTR1 O43613 1/20 0.32
NFKB1 P19838 1/20 0.32
NFKB2 Q00653 1/20 0.32
KMT2A Q03164 1/20 0.32
RELA Q04206 1/20 0.32
MAPK1 P28482 1/20 0.32
MCL1 Q07820 1/20 0.32
PTGIR P43119 1/20 0.32
CYP1A2 P05177 1/20 0.32
PTPN7 P35236 1/20 0.30
DUSP3 P51452 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
SCHEMBL21398777 0.94 TNKS (0.33) GPR3KDM4EMAPTALDH1A1HPGD
SCHEMBL21281890 0.93 MAPT (0.35) GPR3KDM4EMAPTALDH1A1HPGD
SCHEMBL19656421 0.90 GPR3 (0.37) GPR3KDM4EMAPTALDH1A1HPGD
SCHEMBL21398641 0.89 GPR3 (0.38) GPR3KDM4EMAPTALDH1A1HPGD
SCHEMBL15964370 0.89 GPR3 (0.40) GPR3KDM4EMAPTALDH1A1HPGD
SCHEMBL21281887 0.89 MCL1 (0.39) GPR3KDM4EMAPTALDH1A1MEN1
SCHEMBL22161245 0.87 GPR3 (0.39) GPR3KDM4EMAPTALDH1A1HPGD
SCHEMBL22147245 0.87 GPR3 (0.39) GPR3KDM4EMAPTALDH1A1HPGD
SCHEMBL21398642 0.87 MAPT (0.32) GPR3KDM4EMAPTALDH1A1HPGD
SCHEMBL19656481 0.87 LIMK1 (0.33) GPR3MAPTALDH1A1HPGDRAB9A

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-20190296244-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME AND ELECTRONIC DEVICE THEREFOR DUK SAN NEOLUX CO., LTD. (KR) 2019-09-26 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-20190296244-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME AND ELECTRONIC DEVICE THEREFOR OR51E2, WEE2, WEE1 GPR3 4719/4885KDM4E 1329/4885MAPT 2405/4885

“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.