SCHEMBL28284102

SCHEMBL28284102

N#Cc1cc(N)n(-c2ccc(O)cc2)n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.41
▸ PTGS2 P35354 1/20 0.39
▸ MEN1 O00255 7/20 0.38
▸ KMT2A Q03164 7/20 0.38
▸ MAPT P10636 5/20 0.38
▸ RAB9A P51151 4/20 0.38
▸ SMN1; SMN2 Q16637 4/20 0.38
▸ NPC1 O15118 3/20 0.38
▸ CYP1A2 P05177 2/20 0.38
▸ CYP2C19 P33261 2/20 0.38
▸ TP53 P04637 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ KDM4E B2RXH2 2/20 0.36
▸ TSHR P16473 3/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ CA12 O43570 1/20 0.35
▸ CA2 P00918 1/20 0.35
▸ CA3 P07451 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
SCHEMBL29083293 0.85 XDH (0.42) LMNAPTGS2MEN1KMT2AMAPT
SCHEMBL28226658 0.83 PTGS2 (0.54) LMNAPTGS2MEN1KMT2AMAPT
SCHEMBL28395393 0.83 MAPT (0.57) LMNAMEN1KMT2AMAPTRAB9A
SCHEMBL244194 0.83 MAPK1 (0.56) LMNAMEN1KMT2AMAPTRAB9A
SCHEMBL28227470 0.81 LOXL2 (0.42) LMNAPTGS2MEN1KMT2AMAPT
SCHEMBL28400665 0.81 LMNA (0.65) LMNAPTGS2MEN1KMT2AMAPT
SCHEMBL28393672 0.80 NPY5R (0.41) LMNAPTGS2MEN1KMT2ACYP2C9
SCHEMBL28248341 0.78 MAPT (0.49) LMNAMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL28871152 0.77 MAPT (0.48) LMNAPTGS2MEN1KMT2AMAPT
SCHEMBL19388861 0.77 RAB9A (0.43) LMNAMEN1KMT2AMAPTRAB9A

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109575006-A A kind of diazole pyrazole amide analog derivative and its microwave attenuation materials method and application 中南民族大学 2019-04-05 — — CN disclosed
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