SCHEMBL29645560

SCHEMBL29645560

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
SCHEMBL22979487 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114466850-B [1,2,4] Triazolo [1,5-C ] quinazolin-5-amine 拜耳股份有限公司 2024-09-10 CN claimed
EP-4013508-A1 [1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-AMINES Bayer Aktiengesellschaft (DE) 2022-06-22 EP claimed
CN-114466850-A [1,2,4] triazolo [1,5-C ] quinazolin-5-amines 拜耳股份有限公司 2022-05-10 CN claimed