SCHEMBL22979595

SCHEMBL22979595

O=C1NCCCC[C@H]1Nc1nc2ccccc2c2nc(-c3cc(Br)ccc3OC(F)(F)F)nn12

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 12/20 0.37
ADRA2A P08913 11/20 0.37
NPY5R Q15761 7/20 0.37
MKNK1 Q9BUB5 2/20 0.35
MKNK2 Q9HBH9 2/20 0.35
MGLL Q99685 2/20 0.35
ADORA2A P29274 1/20 0.34
ADORA1 P30542 1/20 0.34
ACP1 P24666 1/20 0.33
PLAT P00750 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
SCHEMBL29648543 1.00 MCHR1 (0.37) MCHR1ADRA2ANPY5RMKNK1MKNK2
SCHEMBL22980903 1.00 MCHR1 (0.37) MCHR1ADRA2ANPY5RMKNK1MKNK2
SCHEMBL29648731 1.00 MCHR1 (0.37) MCHR1ADRA2ANPY5RMKNK1MKNK2
SCHEMBL22979537 0.95 MCHR1 (0.39) MCHR1ADRA2ANPY5RMKNK1MKNK2
SCHEMBL22979327 0.95 MCHR1 (0.39) MCHR1ADRA2ANPY5RMKNK1MKNK2
SCHEMBL29648650 0.95 MCHR1 (0.39) MCHR1ADRA2ANPY5RMKNK1MKNK2
SCHEMBL29648768 0.95 MCHR1 (0.39) MCHR1ADRA2ANPY5RMKNK1MKNK2
SCHEMBL22981140 0.92 MAPT (0.36) MKNK1MKNK2MGLLADORA2AADORA1
SCHEMBL22979040 0.92 MAPT (0.36) MKNK1MKNK2MGLLADORA2AADORA1
SCHEMBL29648649 0.92 MAPT (0.36) MKNK1MKNK2MGLLADORA2AADORA1

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 6 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 claimed
EP-4013508-A1 [1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-AMINES Bayer Aktiengesellschaft (DE) 2022-06-22 EP claimed
WO-2021028382-A1 [1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-AMINES BAYER AKTIENGESELLSCHAFT (DE) 2021-02-18 WO claimed
US-20230113037-A1 [1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-AMINES BAYER AKTIENGESELLSCHAFT (DE) 2023-04-13 US disclosed
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 MCHR1 185/4885ADRA2A 207/4885NPY5R 369/4885

“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.