SCHEMBL7854268

SCHEMBL7854268

N=C(N)c1ccc2c(OC(=O)C(F)(F)F)c(C(=O)Nc3ccc4[nH]ccc4c3)ccc2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 3/20 0.46
▸ RAB9A P51151 3/20 0.46
▸ F2 P00734 2/20 0.46
▸ CFTR P13569 2/20 0.43
▸ MAPT P10636 2/20 0.43
▸ ESR1 P03372 3/20 0.42
▸ MAOA P21397 2/20 0.42
▸ MAOB P27338 1/20 0.42
▸ PRKCI P41743 1/20 0.41
▸ PLAU P00749 2/20 0.39
▸ PLG P00747 1/20 0.39
▸ KLKB1 P03952 1/20 0.39
▸ PRSS1 P07477 1/20 0.39
▸ KLK1 P06870 1/20 0.38
▸ KLK5 Q9Y337 1/20 0.38
▸ GABRA1 P14867 1/20 0.38
▸ GABRB1 P18505 1/20 0.38
▸ GABRA5 P31644 1/20 0.38
▸ GABRA3 P34903 1/20 0.38
▸ GABRA2 P47869 1/20 0.38

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
SCHEMBL7853605 0.86 PLAU (0.48) NPC1RAB9AF2PLAUPLG
SCHEMBL7359141 0.83 PLAU (0.50) F2PLAUPLGKLKB1PRSS1
SCHEMBL7344367 0.81 PLAU (0.48) NPC1RAB9AF2PLAUPLG
Trifluoroacetic Acid SCHEMBL7854264 0.79 NPC1 (0.58) NPC1RAB9AF2MAPTESR1
SCHEMBL7854754 0.79 PLAU (0.64) F2PLAUPLGKLKB1PRSS1
SCHEMBL7853919 0.78 PLAU (0.66) NPC1RAB9AF2PLAUPLG
SCHEMBL7340137 0.78 F2 (0.65) NPC1RAB9AF2MAPTMAOA
SCHEMBL7856137 0.77 PLAU (0.67) F2PLAUPLGKLKB1PRSS1
SCHEMBL7852369 0.75 SORT1 (0.46) NPC1RAB9AMAPT
SCHEMBL7855528 0.74 PLAU (0.49) F2PLAUPLGKLKB1PRSS1

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-20010049374-A1 Urokinase inhibitors STEELE ANDREW W (US) 2001-12-06 — — 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-20010049374-A1 Urokinase inhibitors SERPINE1, PLAU, SERPINB1 NPC1 2478/4885RAB9A 2845/4885F2 38/4885

“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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