SCHEMBL29832325

SCHEMBL29832325

CCCCn1c(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2)nc2c(Nc3ccccc3C)cccc21

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CASR P41180 2/20 0.43
▸ TP53 P04637 3/20 0.42
▸ TLR8 Q9NR97 1/20 0.41
▸ PGR P06401 1/20 0.39
▸ RORA P35398 1/20 0.39
▸ RORC P51449 1/20 0.39
▸ RORB Q92753 1/20 0.39
▸ GRM5 P41594 2/20 0.38
▸ MEN1 O00255 3/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ PDE4B Q07343 4/20 0.37
▸ GAA P10253 2/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ HTT P42858 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ L3MBTL1 Q9Y468 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
SCHEMBL26106624 1.00 CASR (0.43) CASRTP53TLR8PGRRORA
SCHEMBL26492006 0.91 CASR (0.49) CASRTP53TLR8PGRRORA
SCHEMBL26106598 0.84 CASR (0.55) CASRTP53TLR8PGRRORA
SCHEMBL29832406 0.84 CASR (0.55) CASRTP53TLR8PGRRORA
SCHEMBL26486218 0.84 TLR8 (0.40) CASRTP53TLR8PGRRORA
SCHEMBL26486238 0.83 CASR (0.48) CASRTP53TLR8PGRRORA
SCHEMBL26110781 0.83 PGR (0.47) CASRTP53TLR8PGRRORA
SCHEMBL29832305 0.83 PGR (0.47) CASRTP53TLR8PGRRORA
SCHEMBL26486241 0.82 CASR (0.49) CASRTP53TLR8PGRRORA
SCHEMBL26486327 0.80 CASR (0.47) CASRTP53TLR8PGRRORA

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-4298136-A1 AMINO-BENZIMIDAZOLE CATALYSTS FOR THE PREPARATION OF POLYOLEFINS Dow Global Technologies LLC (US) 2024-01-03 — — EP disclosed
WO-2022183008-A9 AMINO-BENZIMIDAZOLE CATALYSTS FOR THE PREPARATION OF POLYOLEFINS DOW GLOBAL TECHNOLOGIES LLC (US) 2023-10-12 — — WO disclosed
WO-2022183008-A1 AMINO-BENZIMIDAZOLE CATALYSTS FOR THE PREPARATION OF POLYOLEFINS DOW GLOBAL TECHNOLOGIES LLC (US) 2022-09-01 — — WO disclosed
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