SCHEMBL22987489

SCHEMBL22987489

Cn1cc(-c2nc3c4c(Cl)cccc4nc(Cl)n3n2)cn1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 4/20 0.48
ADORA2A P29274 3/20 0.44
ADORA1 P30542 3/20 0.44
IRAK4 Q9NWZ3 1/20 0.39
EPHX2 P34913 1/20 0.37
CSF1R P07333 3/20 0.36
MAOB P27338 1/20 0.36
FGFR3 P22607 1/20 0.35
KDR P35968 1/20 0.35
TTK P33981 2/20 0.35
CCNA2 P20248 1/20 0.35
CDK2 P24941 1/20 0.35
LMNA P02545 1/20 0.35
MET P08581 2/20 0.34
KDM1A O60341 1/20 0.34
CNR2 P34972 2/20 0.33
CNR1 P21554 1/20 0.33

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
SCHEMBL22987482 0.89 ADORA3 (0.38) ADORA3ADORA2AADORA1IRAK4EPHX2
SCHEMBL22987454 0.88 ADORA3 (0.38) ADORA3ADORA2AADORA1IRAK4EPHX2
SCHEMBL22987558 0.88 HSP90AB1 (0.41) ADORA3ADORA2AADORA1IRAK4EPHX2
SCHEMBL22988032 0.85 CNR1 (0.39) ADORA3CNR2CNR1
SCHEMBL22987841 0.85 ADORA3 (0.36) ADORA3ADORA2AADORA1IRAK4EPHX2
SCHEMBL22987472 0.85 PDE10A (0.39) ADORA3ADORA2AADORA1IRAK4EPHX2
SCHEMBL22978978 0.83 ADORA3 (0.49) ADORA3ADORA2AADORA1KDM1A
SCHEMBL22979975 0.81 HSP90AB1 (0.42) ADORA3ADORA2AADORA1IRAK4CSF1R
SCHEMBL29450036 0.80 MET (0.40) ADORA3ADORA2AADORA1EPHX2MAOB
SCHEMBL22987491 0.78 ADORA3 (0.52) ADORA3ADORA2AADORA1LMNA

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 ADORA3 34/4885ADORA2A 103/4885ADORA1 21/4885

“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.