SCHEMBL1129520

SCHEMBL1129520

CC(C)(C)C1=C2C=NC=C[N+]2(N)C(c2ccc(Oc3ccccc3)cc2)=N1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TNK2 Q07912 1/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
LCK P06239 1/20 0.32
SRC P12931 1/20 0.32
KDR P35968 1/20 0.32
TEK Q02763 1/20 0.32
XDH P47989 1/20 0.32
BTK Q06187 3/20 0.31
LTA4H P09960 4/20 0.31
MAOA P21397 1/20 0.31
SCN4A P35499 1/20 0.31
GSTP1 P09211 1/20 0.31
CHEK2 O96017 1/20 0.30
TLR8 Q9NR97 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
SCHEMBL1129193 0.82 NPC1 (0.34) NPC1RAB9ALCKKDRTEK
SCHEMBL1131147 0.82 NPC1 (0.34) TNK2NPC1RAB9AXDHBTK
SCHEMBL1128759 0.82 LTA4H (0.34) TNK2NPC1RAB9AXDHLTA4H
SCHEMBL1131714 0.82 ACACB (0.34) TNK2NPC1RAB9ALCKSRC
SCHEMBL13504843 0.82 NPC1 (0.35) TNK2NPC1RAB9AXDHLTA4H
SCHEMBL4357979 0.81 LTA4H (0.42) TNK2NPC1RAB9ABTKLTA4H
SCHEMBL4352081 0.80 MAOA (0.43) TNK2NPC1RAB9AXDHBTK
SCHEMBL14574861 0.79 SRC (0.38) NPC1RAB9ALCKSRCKDR
SCHEMBL4353437 0.79 MAPK14 (0.36) TNK2NPC1RAB9AXDHBTK
SCHEMBL4363018 0.79 LTA4H (0.42) TNK2NPC1RAB9AXDHBTK

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 TNK2 2837/4885NPC1 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.