SCHEMBL22988024

SCHEMBL22988024

Fc1ccc(-c2nc3c4cccc(F)c4nc(Cl)n3n2)cc1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.46
ADORA3 P0DMS8 8/20 0.45
ADORA1 P30542 5/20 0.43
ADORA2A P29274 3/20 0.43
XDH P47989 1/20 0.42
GRM2 Q14416 1/20 0.39
ADORA2B P29275 1/20 0.38
GRM5 P41594 1/20 0.37
PDE10A Q9Y233 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MAPT P10636 1/20 0.37

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
SCHEMBL22988176 0.90 TP53 (0.46) TP53ADORA3ADORA1ADORA2AXDH
SCHEMBL29646404 0.87 RXFP1 (0.44) TP53XDHPDE10AMAPT
SCHEMBL22980130 0.87 RXFP1 (0.44) TP53XDHPDE10AMAPT
SCHEMBL22987977 0.87 TP53 (0.47) TP53ADORA3ADORA1ADORA2AXDH
SCHEMBL22987462 0.87 KDM4E (0.50) TP53ADORA3ADORA1ADORA2AXDH
SCHEMBL22987510 0.85 NR1H2 (0.50) TP53ADORA3ADORA1ADORA2AXDH
SCHEMBL29646319 0.81 ADORA3 (0.61) TP53ADORA3ADORA1ADORA2AMAPT
SCHEMBL22979754 0.81 ADORA3 (0.61) TP53ADORA3ADORA1ADORA2AMAPT
SCHEMBL22987463 0.81 ADORA3 (0.39) TP53ADORA3ADORA1ADORA2APDE10A
SCHEMBL22987707 0.78 ADORA3 (0.39) TP53ADORA3ADORA1ADORA2AADORA2B

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 TP53 242/4885ADORA3 34/4885ADORA1 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.