SCHEMBL29648554

SCHEMBL29648554

O=C1NCCCC[C@H]1Nc1nc2ccc(C(F)(F)F)cc2c2nc(-c3ccccc3F)nn12

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAT2A P31153 4/20 0.39
TACR2 P21452 2/20 0.38
TACR1 P25103 2/20 0.38
MKNK1 Q9BUB5 2/20 0.35
MKNK2 Q9HBH9 2/20 0.35
ADORA2A P29274 1/20 0.35
ADORA1 P30542 1/20 0.35
GBA1 P04062 1/20 0.35

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
SCHEMBL22979721 1.00 MAT2A (0.39) MAT2ATACR2TACR1MKNK1MKNK2
SCHEMBL22979151 0.90 MKNK1 (0.37) MKNK1MKNK2ADORA2AADORA1GBA1
SCHEMBL31149956 0.90 MKNK1 (0.37) MKNK1MKNK2ADORA2AADORA1GBA1
SCHEMBL22988329 0.88 GBA1 (0.44) MKNK1MKNK2ADORA2AADORA1GBA1
SCHEMBL30393088 0.88 GBA1 (0.44) MKNK1MKNK2ADORA2AADORA1GBA1
SCHEMBL29648821 0.87 TACR2 (0.41) TACR2TACR1ADORA2AADORA1
SCHEMBL22980986 0.87 TACR2 (0.41) TACR2TACR1ADORA2AADORA1
SCHEMBL22979759 0.87 HPGDS (0.39) MKNK1MKNK2ADORA2AADORA1
SCHEMBL29648542 0.87 HPGDS (0.39) MKNK1MKNK2ADORA2AADORA1
SCHEMBL22979756 0.83 ADORA3 (0.44)

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
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