SCHEMBL1129124

SCHEMBL1129124

N[N+]12C=CN=CC1=C(c1cc[nH]n1)N=C2c1ccc(Oc2ccccc2)cc1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
XDH P47989 1/20 0.33
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
LTA4H P09960 1/20 0.30
SCN4A P35499 1/20 0.30
CHEK2 O96017 1/20 0.30
ERBB2 P04626 1/20 0.30
BTK Q06187 1/20 0.30

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
SCHEMBL4357630 0.85 NTRK1 (0.34) BTK
SCHEMBL1131147 0.85 NPC1 (0.34) XDHNPC1RAB9ALTA4HSCN4A
SCHEMBL4356460 0.83 TNK2 (0.34) BTK
SCHEMBL4540501 0.83 TNK2 (0.37) XDHNPC1RAB9ALTA4HSCN4A
SCHEMBL4352081 0.82 MAOA (0.43) XDHNPC1RAB9ACHEK2BTK
SCHEMBL4357979 0.81 LTA4H (0.42) NPC1RAB9ALTA4HBTK
SCHEMBL4353437 0.81 MAPK14 (0.36) XDHNPC1RAB9ALTA4HSCN4A
SCHEMBL4363018 0.81 LTA4H (0.42) XDHNPC1RAB9ALTA4HSCN4A
SCHEMBL4361491 0.80 BTK (0.38) XDHNPC1RAB9ALTA4HSCN4A
SCHEMBL4352096 0.80 TNK2 (0.36) XDHNPC1RAB9ACHEK2

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8481733-B2 Substituted imidazopyr- and imidazotri-azines OSI Pharmaceuticals, LLC (US) 2013-07-09 US claimed
EP-2283020-B1 SUBSTITUTED IMIDAZOPYR-AND IMIDAZOTRI-AZINES OSI PHARM INC (US) 2012-10-31 EP claimed
US-8481733-B2 Substituted imidazopyr- and imidazotri-azines OSI Pharmaceuticals, LLC (US) 2013-07-09 US disclosed
EP-2283020-B1 SUBSTITUTED IMIDAZOPYR-AND IMIDAZOTRI-AZINES OSI PHARM INC (US) 2012-10-31 EP disclosed
EP-2283020-A1 SUBSTITUTED IMIDAZOPYR-AND IMIDAZOTRI-AZINES OSI Pharmaceuticals, Inc. (US) 2011-02-16 EP disclosed
WO-2009143051-A1 SUBSTITUTED IMIDAZOPYR-AND IMIDAZOTRI-AZINES OSI PHARMACEUTICALS, INC. (US) 2009-11-26 WO disclosed
US-20090286768-A1 SUBSTITUTED IMIDAZOPYR- AND IMIDAZOTRI-AZINES OSI PHARMACEUTICALS, INC. (US) 2009-11-19 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-20090286768-A1 SUBSTITUTED IMIDAZOPYR- AND IMIDAZOTRI-AZINES ABL1, TPMT, CYP2C19 XDH 145/4885NPC1 294/4885RAB9A 687/4885

“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.