SCHEMBL31228708

SCHEMBL31228708

CCc1nc(-c2ccccc2-c2n[nH]c(CC)n2)n[nH]1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 3/20 0.50
NR1H3 Q13133 2/20 0.50
RAB9A P51151 5/20 0.47
NPC1 O15118 5/20 0.44
POLB P06746 1/20 0.44
LMNA P02545 1/20 0.42
DDAH1 O94760 1/20 0.40
BRD4 O60885 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.38
ADORA2A P29274 1/20 0.37
ALPL P05186 2/20 0.37
ROCK2 O75116 2/20 0.37
GRK2 P25098 1/20 0.37
KDM4E B2RXH2 1/20 0.37
NFKB1 P19838 1/20 0.37
HTT P42858 1/20 0.37
NFKB2 Q00653 1/20 0.37
RELA Q04206 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
MEN1 O00255 1/20 0.36

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
SCHEMBL26108844 1.00 NR1H2 (0.50) NR1H2NR1H3RAB9ANPC1POLB
SCHEMBL1696584 0.82 NR1H2 (0.66) NR1H2NR1H3RAB9ANPC1POLB
SCHEMBL16877127 0.73 NR1H2 (0.48) NR1H2NR1H3RAB9ANPC1POLB
SCHEMBL7659462 0.72 DDX3X (0.43) NR1H2NR1H3LMNAADORA2AALPL
SCHEMBL28637014 0.68 AOC3 (0.41) NR1H2NR1H3RAB9ANPC1SMN1; SMN2
SCHEMBL5681247 0.67 TRPA1 (0.40) RAB9ANPC1POLBLMNABRD4
SCHEMBL31272631 0.67 GAA (0.57) RAB9ANPC1LMNASMN1; SMN2KDM4E
SCHEMBL1899895 0.66 NR1H2 (0.58) NR1H2NR1H3RAB9ANPC1POLB
SCHEMBL18094996 0.65 CYP1A2 (0.43) NR1H2RAB9ANPC1POLBADORA2A
SCHEMBL15026754 0.65 AOC3 (0.44) NR1H2NR1H3RAB9ANPC1POLB

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
EP-4722199-A1 AZOLE COMPOUND, METHOD FOR SYNTHESIZING SAID AZOLE COMPOUND, AND USE THEREOF SHIKOKU CHEMICALS CORPORATION (JP) 2026-04-08 EP disclosed
WO-2024247919-A1 AZOLE COMPOUND, METHOD FOR SYNTHESIZING SAID AZOLE COMPOUND, AND USE THEREOF 四国化成工業株式会社 2024-12-05 WO disclosed
CN-118922427-A Triazole compound, synthesis method of triazole compound, coupling agent and application thereof 四国化成工业株式会社 2024-11-08 CN disclosed