SCHEMBL14629802

SCHEMBL14629802

CNC(=N)c1ccc(C(=O)Nc2ccsc2C(=O)Nc2ccc(CI)cn2)c(F)c1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
F10 P00742 16/20 0.47
KCNH2 Q12809 4/20 0.46
KLKB1 P03952 3/20 0.38
NPC1 O15118 1/20 0.37
PKM P14618 1/20 0.37
RAB9A P51151 1/20 0.37

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
SCHEMBL14629808 0.90 F10 (0.46) F10KCNH2KLKB1
SCHEMBL10179737 0.88 NPC1 (0.51) F10KCNH2NPC1PKMRAB9A
SCHEMBL12133048 0.87 F10 (0.62) F10KCNH2
SCHEMBL14404271 0.86 F10 (0.49) F10KCNH2NPC1RAB9A
SCHEMBL14404489 0.85 F10 (0.52) F10KCNH2KLKB1
SCHEMBL14404620 0.78 F10 (0.56) F10KCNH2KLKB1NPC1PKM
SCHEMBL10181011 0.78 NPC1 (0.52) F10KCNH2NPC1PKMRAB9A
SCHEMBL14629909 0.77 F10 (0.70) F10KCNH2
SCHEMBL12134527 0.77 F10 (0.62) F10KCNH2NPC1PKMRAB9A
SCHEMBL14404272 0.77 F10 (0.58) F10KCNH2KLKB1

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-20070021472-A1 N-(5-bromo-2-pyridinyl)-(2-4-[(2-aminosulfonyl)phenyl]phenylcarbonylamino)phenylcarboxamide; potent and highly selective inhibitors; coagulation disorders; antithrombotic agents; diagnostic reagents; good bioavailability and/or solubility MILLENNIUM PHARMACEUTICALS, INC. 2007-01-25 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-20070021472-A1 N-(5-bromo-2-pyridinyl)-(2-4-[(2-aminosulfonyl)phenyl]phenylcarbonylamino)phenylcarboxamide; potent and highly selective inhibitors; coagulation disorders; antithrombotic agents; diagnostic reagents; good bioavailability and/or solubility F2, TFPI, PLG F10 18/4885KCNH2 1101/4885KLKB1 251/4885

“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.