SCHEMBL6160868

SCHEMBL6160868

CCCCCCCCCC(=O)OC(CC)c1nc(C(C)C)c(Sc2cc(Cl)cc(Cl)c2)[nH]1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.36
MAPT P10636 3/20 0.32
MAPK1 P28482 1/20 0.32
GPR84 Q9NQS5 1/20 0.31
ALDH1A1 P00352 2/20 0.31
RECQL P46063 2/20 0.31
TSHR P16473 1/20 0.31
GAA P10253 1/20 0.30

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
SCHEMBL6161094 1.00 LMNA (0.36) LMNAMAPTMAPK1GPR84ALDH1A1
SCHEMBL6159934 0.88 GPR84 (0.31) GPR84
SCHEMBL6162360 0.78 HPGD (0.33) MAPTALDH1A1
SCHEMBL6966214 0.77
SCHEMBL6161865 0.74 NPC1 (0.30)
SCHEMBL6160630 0.74 NPC1 (0.30)
SCHEMBL7079384 0.73
SCHEMBL6162089 0.72 LMNA (0.36) LMNAMAPTMAPK1ALDH1A1GAA
SCHEMBL7080940 0.72 MEN1 (0.31) LMNAMAPTALDH1A1
SCHEMBL3453582 0.72 CDC7 (0.32) LMNAMAPTALDH1A1

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-0893442-B1 LYMPH-ABSORBABLE IMIDAZOLE DERIVATIVES SHIONOGI & CO (JP) 2005-01-12 EP disclosed
US-6054591-A LYMPHOTROPIC ANTI-AIDS AGENT SHIONOGI & CO., LTD. (JP) 2000-04-25 US disclosed
EP-0893442-A1 LYMPH-ABSORBABLE IMIDAZOLE DERIVATIVES SHIONOGI & CO., LTD. (JP) 1999-01-27 EP disclosed