SCHEMBL26487228

SCHEMBL26487228

CCCCn1c(C(C)C)nc2c(Nc3cc(C)cc(C)c3)cccc21

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CASR P41180 2/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ TLR8 Q9NR97 6/20 0.39
▸ GAA P10253 1/20 0.38
▸ TP53 P04637 2/20 0.37
▸ GRM5 P41594 2/20 0.36
▸ USP2 O75604 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ RXFP1 Q9HBX9 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
SCHEMBL26109536 0.86 CASR (0.41) CASRSMN1; SMN2TLR8GAAGRM5
SCHEMBL29832252 0.86 CASR (0.41) CASRSMN1; SMN2TLR8GAAGRM5
SCHEMBL29832214 0.84 TLR8 (0.45) CASRSMN1; SMN2TLR8GAATP53
SCHEMBL26107500 0.84 TLR8 (0.45) CASRSMN1; SMN2TLR8GAATP53
SCHEMBL29832081 0.82 CASR (0.50) CASRSMN1; SMN2TLR8GAAUSP2
SCHEMBL26105278 0.82 CASR (0.50) CASRSMN1; SMN2TLR8GAAUSP2
SCHEMBL29832612 0.82 CASR (0.50) CASRSMN1; SMN2TLR8GAAUSP2
SCHEMBL26109039 0.82 CASR (0.50) CASRSMN1; SMN2TLR8GAAUSP2
SCHEMBL29832217 0.81 CASR (0.40) CASRSMN1; SMN2TLR8GAAUSP2
SCHEMBL26108404 0.81 CASR (0.40) CASRSMN1; SMN2TLR8GAAUSP2

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
WO-2022183008-A9 AMINO-BENZIMIDAZOLE CATALYSTS FOR THE PREPARATION OF POLYOLEFINS DOW GLOBAL TECHNOLOGIES LLC (US) 2023-10-12 — — WO disclosed
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