SCHEMBL6389242

SCHEMBL6389242

NC(=O)N(c1ccc(-c2csc3ccnc(N)c23)cc1)c1cccc([N+](=O)[O-])c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 20/20 0.50
▸ AURKA O14965 5/20 0.48
▸ AURKB Q96GD4 5/20 0.48
▸ ROCK2 O75116 4/20 0.48
▸ RPS6KA5 O75582 4/20 0.48
▸ MAP4K4 O95819 4/20 0.48
▸ LCK P06239 4/20 0.48
▸ LYN P07948 4/20 0.48
▸ RET P07949 4/20 0.48
▸ FGFR1 P11362 4/20 0.48
▸ FLT1 P17948 4/20 0.48
▸ RPS6KB1 P23443 4/20 0.48
▸ AXL P30530 4/20 0.48
▸ FLT3 P36888 4/20 0.48
▸ FRK P42685 4/20 0.48
▸ CSNK1A1 P48729 4/20 0.48
▸ CSNK1D P48730 4/20 0.48
▸ CLK2 P49760 4/20 0.48
▸ BLK P51451 4/20 0.48
▸ RPS6KA3 P51812 4/20 0.48

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
SCHEMBL6390212 0.79 KDR (0.56) KDRAURKAAURKBROCK2RPS6KA5
SCHEMBL3526174 0.79 KDR (0.74) KDRAURKAAURKBROCK2RPS6KA5
SCHEMBL6385546 0.77 KDR (0.52) KDRAURKAAURKBROCK2RPS6KA5
SCHEMBL27636493 0.74 KDR (0.63) KDRAURKBROCK2RPS6KA5MAP4K4
SCHEMBL3609309 0.74 KDR (0.56) KDRAURKAAURKBROCK2RPS6KA5
SCHEMBL30883193 0.73 TSHR (0.57) —
SCHEMBL27661176 0.72 KDR (0.53) KDRAURKAAURKBROCK2LCK
SCHEMBL16879411 0.72 TSHR (0.53) —
SCHEMBL6387113 0.71 EPHB4 (0.48) KDRAURKAAURKBROCK2RPS6KA5
SCHEMBL27661163 0.70 KDR (0.54) KDRAURKAAURKBROCK2RPS6KA5

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-20050020619-A1 Thienopyridine kinase inhibitors ABBOTT LABORATORIES 2005-01-27 — — 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-20050020619-A1 Thienopyridine kinase inhibitors ABL1, MAP4K2, MAP4K5 KDR 511/4885AURKA 293/4885AURKB 262/4885

“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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