SCHEMBL22979487

SCHEMBL22979487

O=C1NCC[C@H]1Nc1nc2ccccc2c2nc(-c3cc(Cl)ccc3OC(F)(F)F)nn12

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 4/20 0.37
FPR2 P25090 1/20 0.37
MAPT P10636 2/20 0.36
PLAT P00750 3/20 0.35
HPGDS O60760 1/20 0.35
MGLL Q99685 1/20 0.35
TP53 P04637 1/20 0.35
DDB1 Q16531 1/20 0.34
CRBN Q96SW2 1/20 0.34
ADORA3 P0DMS8 1/20 0.34
HCRTR1 O43613 1/20 0.34
HCRTR2 O43614 1/20 0.34

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
SCHEMBL29645560 1.00 SCN9A (0.37) SCN9AFPR2MAPTPLATHPGDS
SCHEMBL22979398 0.95 MAPT (0.35) SCN9AFPR2MAPTPLATMGLL
SCHEMBL29645450 0.95 MAPT (0.35) SCN9AFPR2MAPTPLATMGLL
SCHEMBL22979155 0.95 MKNK1 (0.35) SCN9AFPR2MAPTMGLLTP53
SCHEMBL29648688 0.95 MKNK1 (0.35) SCN9AFPR2MAPTMGLLTP53
SCHEMBL22979255 0.95 MKNK1 (0.35) SCN9AFPR2MAPTMGLLTP53
SCHEMBL29648646 0.95 MKNK1 (0.35) SCN9AFPR2MAPTMGLLTP53
SCHEMBL22980806 0.94 MAPT (0.37) SCN9AFPR2MAPTPLATHPGDS
SCHEMBL29645751 0.94 MAPT (0.37) SCN9AFPR2MAPTPLATHPGDS
SCHEMBL22980841 0.91 PLAT (0.40) SCN9AMAPTPLATHPGDSMGLL

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 SCN9A 3610/4885FPR2 320/4885MAPT 4047/4885

“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.