SCHEMBL14323255

SCHEMBL14323255

Cc1cc(Br)cc(Nc2cc(Cl)ncn2)c1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.50
▸ EGFR P00533 10/20 0.39
▸ FGFR1 P11362 1/20 0.39
▸ MKNK1 Q9BUB5 1/20 0.39
▸ KDR P35968 1/20 0.38
▸ TNNI3K Q59H18 2/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ ERBB3 P21860 2/20 0.35
▸ LMNA P02545 1/20 0.34
▸ MAPK10 P53779 1/20 0.34

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
SCHEMBL1285052 0.77 NPC1 (0.55) NPC1EGFRMKNK1MEN1KMT2A
SCHEMBL28805101 0.77 NPC1 (0.69) NPC1EGFRMKNK1TNNI3KMEN1
SCHEMBL5025314 0.77 NPC1 (0.64) NPC1EGFRMKNK1MEN1KMT2A
SCHEMBL2279629 0.76 EGFR (0.59) NPC1EGFRMKNK1TNNI3KERBB3
SCHEMBL691533 0.76 EGFR (0.57) NPC1EGFRTNNI3KERBB3
SCHEMBL12517775 0.75 NPC1 (0.43) NPC1EGFRFGFR1MKNK1KDR
SCHEMBL1285874 0.74 NPC1 (0.53) NPC1EGFRFGFR1MKNK1MEN1
SCHEMBL16205250 0.74 MEN1 (0.49) NPC1KDRTNNI3KMEN1KMT2A
SCHEMBL14322256 0.73 RAPGEF4 (0.46) MEN1KMT2A
SCHEMBL857502 0.69 NPC1 (0.63) NPC1EGFRMKNK1TNNI3KMEN1

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-20120329784-A1 COMPOUNDS AND METHODS GLAXOSMITHKLINE LLC 2012-12-27 — — 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-20120329784-A1 COMPOUNDS AND METHODS RB1, DHFR, NQO1 NPC1 383/4885EGFR 888/4885FGFR1 1844/4885

“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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