SCHEMBL12362292

SCHEMBL12362292

COc1ccc(C2=NCCN2)c(N)c1C

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PDCD1LG2 Q9BQ51 4/20 0.49
▸ CD274 Q9NZQ7 4/20 0.49
▸ NISCH Q9Y2I1 8/20 0.48
▸ ADRA2A P08913 1/20 0.43
▸ ADRA2B P18089 1/20 0.43
▸ ADRA2C P18825 1/20 0.43
▸ ADRA1D P25100 1/20 0.43
▸ ADRA1A P35348 1/20 0.43
▸ ADRA1B P35368 1/20 0.43
▸ MAOB P27338 1/20 0.41

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
SCHEMBL2257985 0.81 NISCH (0.51) PDCD1LG2CD274NISCH
SCHEMBL12362313 0.79 NISCH (0.50) PDCD1LG2CD274NISCH
SCHEMBL81737 0.76 NISCH (0.40) PDCD1LG2CD274NISCH
SCHEMBL82845 0.74 KDM4E (0.47) PDCD1LG2CD274NISCHMAOB
SCHEMBL29618250 0.72 NISCH (0.42) PDCD1LG2CD274NISCHADRA1DADRA1A
SCHEMBL1655501 0.72 NISCH (0.42) PDCD1LG2CD274NISCHADRA1DADRA1A
SCHEMBL4383292 0.72 NISCH (0.70) PDCD1LG2CD274NISCH
SCHEMBL31743071 0.72 NISCH (0.54) PDCD1LG2CD274NISCH
SCHEMBL2258437 0.72 NISCH (0.58) PDCD1LG2CD274NISCHADRA2AADRA2B
SCHEMBL8194659 0.71 NISCH (0.58) PDCD1LG2CD274NISCHADRA2AADRA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8859572-B2 Sulfone substituted 2,3-dihydroimidazo [1,2-C] quinazoline derivatives useful for treating hyper-proliferative disorders and diseases with angiogenesis BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-10-14 — — US disclosed
US-20110190281-A1 SULFONE SUBSTITUTED 2,3-DIHYDROIMIDAZO [1,2-C] QUINAZOLINE DERIVATIVES USEFUL FOR TREATING HYPER-PROLIFERATIVE DISORDERS AND DISEASES WITH ANGIOGENESIS BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2011-08-04 — — 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-20110190281-A1 SULFONE SUBSTITUTED 2,3-DIHYDROIMIDAZO [1,2-C] QUINAZOLINE DERIVATIVES USEFUL FOR TREATING HYPER-PROLIFERATIVE DISORDERS AND DISEASES WITH ANGIOGENESIS PIK3CA, PIK3CD, PIK3CB PDCD1LG2 3347/4885CD274 4402/4885NISCH 2144/4885

“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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