SCHEMBL26323743

SCHEMBL26323743

Cc1ccc2nccc(Nc3ccc(-c4nc5cc(Nc6ccncc6)ccc5[nH]4)cc3)c2c1

nearest known ligand 0.63

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 14/20 0.63
▸ MAPKAPK2 P49137 4/20 0.49
▸ NPC1 O15118 1/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ MET P08581 1/20 0.46
▸ HPSE Q9Y251 1/20 0.43

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
SCHEMBL30180360 0.88 KDR (0.63) KDRMAPKAPK2MET
SCHEMBL23999699 0.88 KDR (0.63) KDRMAPKAPK2MET
SCHEMBL30210280 0.88 KDR (0.63) KDRMAPKAPK2MET
SCHEMBL23999511 0.88 KDR (0.63) KDRMAPKAPK2MET
SCHEMBL23999513 0.85 MAPKAPK2 (0.52) KDRMAPKAPK2
SCHEMBL25455011 0.85 KDR (0.71) KDRNPC1RAB9AMET
SCHEMBL23999449 0.85 MAPKAPK2 (0.52) KDRMAPKAPK2
SCHEMBL30180457 0.84 KDR (0.56) KDRMAPKAPK2MET
SCHEMBL23999898 0.84 KDR (0.56) KDRMAPKAPK2MET
SCHEMBL23999677 0.83 KDR (0.55) KDRMAPKAPK2NPC1RAB9AMET

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-20230295114-A1 AKT3 MODULATORS Georgiamune Inc. 2023-09-21 — — 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-20230295114-A1 AKT3 MODULATORS AKT3, AKT2, MTOR KDR 3433/4885MAPKAPK2 151/4885NPC1 1106/4885

“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.

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