SCHEMBL4353437

SCHEMBL4353437

N[N+]12C=CN=CC1=C(c1ccncc1)N=C2c1ccc(Oc2ccccc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 3/20 0.36
MAPK13 O15264 2/20 0.36
GCGR P47871 2/20 0.36
MAPK12 P53778 2/20 0.36
MAPK11 Q15759 2/20 0.36
BTK Q06187 2/20 0.35
TNK2 Q07912 1/20 0.35
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
LTA4H P09960 3/20 0.32
SCN4A P35499 1/20 0.32
NISCH Q9Y2I1 1/20 0.31
XDH P47989 1/20 0.30
RIPK1 Q13546 1/20 0.30
HRH2 P25021 1/20 0.30
HRH1 P35367 1/20 0.30
HRH3 Q9Y5N1 1/20 0.30
LMNA P02545 1/20 0.30
CYP3A4 P08684 1/20 0.30
HTT P42858 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
SCHEMBL1131147 0.93 NPC1 (0.34) BTKTNK2NPC1RAB9ALTA4H
SCHEMBL4352081 0.89 MAOA (0.43) BTKTNK2NPC1RAB9AXDH
SCHEMBL4363018 0.88 LTA4H (0.42) BTKTNK2NPC1RAB9ALTA4H
SCHEMBL4357979 0.88 LTA4H (0.42) BTKTNK2NPC1RAB9ALTA4H
SCHEMBL4361840 0.85 TNK2 (0.37) TNK2HTTSMN1; SMN2
SCHEMBL4362605 0.85 CHEK2 (0.39) TNK2LMNASMN1; SMN2
SCHEMBL4358063 0.85 SRD5A2 (0.43) BTKTNK2
SCHEMBL1129334 0.85 TNK2 (0.37) TNK2NPC1RAB9A
SCHEMBL4363023 0.85 TNK2 (0.39) TNK2NPC1RAB9ALTA4HSCN4A
SCHEMBL4365325 0.84 PARP10 (0.49) BTKTNK2

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 5 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
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 MAPK14 1744/4885MAPK13 1098/4885GCGR 242/4885

“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.