SCHEMBL26486241

SCHEMBL26486241

CCCCn1c(-c2ccc(C(C)(C)C)cc2)nc2c(Nc3c(C)cccc3C)cccc21

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CASR P41180 2/20 0.49
▸ TLR8 Q9NR97 2/20 0.42
▸ PIN1 Q13526 1/20 0.39
▸ PDE4B Q07343 4/20 0.38
▸ PGR P06401 1/20 0.38
▸ RORA P35398 1/20 0.38
▸ RORC P51449 1/20 0.38
▸ RORB Q92753 1/20 0.38
▸ TP53 P04637 1/20 0.38
▸ KDM4E B2RXH2 3/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ GRM5 P41594 2/20 0.36
▸ HPGD P15428 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ TSHR P16473 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
SCHEMBL26492006 0.92 CASR (0.49) CASRTLR8PIN1PDE4BPGR
SCHEMBL26486334 0.88 CASR (0.61) CASRTLR8PIN1PDE4BPGR
SCHEMBL26492001 0.87 CASR (0.45) CASRTLR8PIN1PDE4BPGR
SCHEMBL26486238 0.86 CASR (0.48) CASRTLR8PIN1PDE4BPGR
SCHEMBL26486327 0.85 CASR (0.47) CASRTLR8PIN1PDE4BPGR
SCHEMBL26486331 0.85 CASR (0.47) CASRPIN1PDE4BPGRRORA
SCHEMBL26492004 0.84 CASR (0.61) CASRTLR8PIN1PDE4BPGR
SCHEMBL26491993 0.84 CASR (0.46) CASRTLR8PIN1PDE4BPGR
SCHEMBL26486222 0.82 TLR8 (0.45) CASRTLR8TP53KDM4EALDH1A1
SCHEMBL29832325 0.82 CASR (0.43) CASRTLR8PDE4BPGRRORA

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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