SCHEMBL22988032

SCHEMBL22988032

Cn1cc(-c2nc3c4c(C#N)cccc4nc(Cl)n3n2)cn1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.39
CNR2 P34972 1/20 0.39
PIK3CD O00329 17/20 0.39
PIK3R1 P27986 6/20 0.39
ADORA3 P0DMS8 1/20 0.36
FASN P49327 1/20 0.35

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
SCHEMBL22987489 0.85 ADORA3 (0.48) CNR1CNR2ADORA3
SCHEMBL22987482 0.84 ADORA3 (0.38) ADORA3
SCHEMBL22987558 0.84 HSP90AB1 (0.41) PIK3CDADORA3
SCHEMBL22987454 0.84 ADORA3 (0.38) ADORA3
SCHEMBL22987741 0.83 PIK3CD (0.41) CNR1CNR2PIK3CDPIK3R1ADORA3
SCHEMBL22987472 0.81 PDE10A (0.39) ADORA3
SCHEMBL22987841 0.81 ADORA3 (0.36) PIK3CDADORA3
SCHEMBL22987587 0.80 ADORA3 (0.39) ADORA3
SCHEMBL22988030 0.80 ADORA3 (0.43) ADORA3
SCHEMBL22978978 0.78 ADORA3 (0.49) ADORA3

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-20230113037-A1 [1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-AMINES BAYER AKTIENGESELLSCHAFT (DE) 2023-04-13 US disclosed
WO-2021028382-A1 [1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-AMINES BAYER AKTIENGESELLSCHAFT (DE) 2021-02-18 WO 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-20230113037-A1 [1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-AMINES AHR, HRH4, HRH1 CNR1 61/4885CNR2 64/4885PIK3CD 2082/4885

“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.