SCHEMBL6403515

SCHEMBL6403515

NC1c2ccoc2N=C(c2ccccc2C(=O)O)N1c1ccc(NC(=O)Nc2cc(C(F)(F)F)ccc2F)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RIPK1 Q13546 2/20 0.45
▸ KDR P35968 17/20 0.45
▸ TEK Q02763 5/20 0.45
▸ EPHB4 P54760 2/20 0.45
▸ KIT P10721 3/20 0.44
▸ FLT3 P36888 3/20 0.44
▸ CA12 O43570 1/20 0.43
▸ CA1 P00915 1/20 0.43
▸ CA2 P00918 1/20 0.43
▸ CA9 Q16790 1/20 0.43
▸ CSF1R P07333 2/20 0.42
▸ SRC P12931 2/20 0.42
▸ FLT1 P17948 2/20 0.42
▸ FLT4 P35916 2/20 0.42
▸ ABL1 P00519 1/20 0.42
▸ LCK P06239 1/20 0.42
▸ FYN P06241 1/20 0.42
▸ LYN P07948 1/20 0.42
▸ BLK P51451 1/20 0.42
▸ PDGFRB P09619 4/20 0.42

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
SCHEMBL4830904 0.87 CA12 (0.47) RIPK1KDRTEKEPHB4KIT
SCHEMBL4826963 0.86 DGAT1 (0.47) RIPK1KDRTEKEPHB4KIT
SCHEMBL4826606 0.84 CA12 (0.48) RIPK1KDRTEKEPHB4KIT
SCHEMBL4833219 0.84 CA12 (0.48) RIPK1KDRTEKEPHB4KIT
SCHEMBL4833129 0.84 KDR (0.47) RIPK1KDRTEKEPHB4KIT
SCHEMBL4833141 0.84 KDR (0.47) RIPK1KDRTEKEPHB4KIT
SCHEMBL4833593 0.82 CA12 (0.54) RIPK1KDRTEKEPHB4KIT
SCHEMBL4833968 0.82 KDR (0.46) RIPK1KDRTEKEPHB4KIT
SCHEMBL4834110 0.82 KDR (0.45) RIPK1KDRTEKEPHB4KIT
SCHEMBL4828862 0.82 KDR (0.51) RIPK1KDRTEKKITFLT3

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-20050004142-A1 Chemical compounds SMITHKLINE BEECHAM CORPORATION 2005-01-06 — — 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-20050004142-A1 Chemical compounds TIE1, KDR, TEK RIPK1 1954/4885KDR 2/4885TEK 3/4885

“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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