SCHEMBL29645872

SCHEMBL29645872

O=C1NCCNC[C@H]1Nc1nc2c(C(F)(F)F)cccc2c2nc(-c3ccc(Cl)cc3OC(F)(F)F)nn12

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PLAT P00750 1/20 0.30
SLC5A1 P13866 1/20 0.30
S1PR2 O95136 1/20 0.30

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
SCHEMBL22988434 1.00 PLAT (0.30) PLATSLC5A1S1PR2
SCHEMBL29645746 0.92 JAK2 (0.30)
SCHEMBL22988435 0.92 JAK2 (0.30)
SCHEMBL22979089 0.90 TACR1 (0.34)
SCHEMBL29648738 0.90 TACR1 (0.34)
SCHEMBL22979156 0.86 NR1H2 (0.37)
SCHEMBL29646197 0.86 NR1H2 (0.37)
SCHEMBL29449970 0.84 PCSK9 (0.32)
SCHEMBL22988083 0.83 TRPC3 (0.35)
SCHEMBL22988358 0.82 MAPT (0.36) PLATSLC5A1

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
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