SCHEMBL21665489

SCHEMBL21665489

c1ccc(-c2ccc3sc4cc(Nc5cccc6c5-c5ccccc5C65c6ccccc6-c6ccccc65)ccc4c3c2)cc1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RIPK2 O43353 3/20 0.36
EGFR P00533 2/20 0.36
TGFBR1 P36897 2/20 0.36
KDR P35968 1/20 0.36
PIM3 Q86V86 1/20 0.33
RIPK3 Q9Y572 1/20 0.32
LIMK1 P53667 1/20 0.32
MAP3K8 P41279 2/20 0.31
SIRT2 Q8IXJ6 1/20 0.31
SIRT1 Q96EB6 1/20 0.31
ALK Q9UM73 1/20 0.31
PTGIR P43119 1/20 0.31
PDK2 Q15119 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
SCHEMBL21665688 0.88 MAPT (0.39) PTGIRPDK2
SCHEMBL21665622 0.86 PTGIR (0.42) EGFRPTGIRPDK2
SCHEMBL23765083 0.83 ALDH1A1 (0.33) PTGIR
SCHEMBL22245911 0.83 MAPT (0.37) PTGIR
SCHEMBL21665630 0.82 SIRT2 (0.45) SIRT2SIRT1ALKPDK2
SCHEMBL24724160 0.81 PIM3 (0.33) RIPK2EGFRTGFBR1KDRPIM3
SCHEMBL24969742 0.81 RIPK2 (0.34) RIPK2EGFRTGFBR1KDRLIMK1
SCHEMBL15250350 0.81 SIRT2 (0.46) SIRT2SIRT1ALKPDK2
SCHEMBL22680496 0.81 PTGIR (0.40) PTGIR
SCHEMBL29839680 0.80 AKR1C3 (0.39) SIRT2SIRT1ALKPDK2

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-20200039993-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREFOR DUK SAN NEOLUX CO., LTD (KR) 2020-02-06 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-20200039993-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREFOR OR51E2, WEE1, WEE2 RIPK2 3659/4885EGFR 2016/4885TGFBR1 3344/4885

“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.