SCHEMBL7213286

SCHEMBL7213286

CCCCCN(C)CCCCOc1ccc2c(c1)CCCN2C(=O)OC(C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.45
ALDH1A1 P00352 3/20 0.44
LMNA P02545 3/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
BRD4 O60885 1/20 0.44
MPO P05164 1/20 0.43
HSD17B10 Q99714 1/20 0.43
TSHR P16473 3/20 0.42
POLB P06746 1/20 0.42
HPGD P15428 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MAOB P27338 3/20 0.41
KDM4E B2RXH2 1/20 0.41
HRH3 Q9Y5N1 1/20 0.41
GPR119 Q8TDV5 1/20 0.41
TP53 P04637 1/20 0.40

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
SCHEMBL5639625 0.89 MAOB (0.44) MAPTALDH1A1LMNASMN1; SMN2BRD4
SCHEMBL5640073 0.88 LSS (0.46) BRD4
SCHEMBL5637249 0.87 LSS (0.47)
SCHEMBL5638760 0.87 LSS (0.47)
SCHEMBL5636674 0.85 GPR119 (0.44) MAPTALDH1A1HPGDMAOBGPR119
SCHEMBL5639016 0.85 HSD17B10 (0.46) MAPTALDH1A1LMNABRD4MPO
SCHEMBL5637860 0.84 HSD17B10 (0.46) MAPTALDH1A1LMNABRD4MPO
SCHEMBL5637990 0.84 HSD17B10 (0.46) MAPTALDH1A1LMNABRD4MPO
SCHEMBL3656194 0.84 HSD17B10 (0.50) MAPTALDH1A1LMNABRD4MPO
SCHEMBL7218398 0.83 MAPT (0.46) MAPTALDH1A1LMNASMN1; SMN2HSD17B10

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1358162-A1 DIHYDROINDOLE AND TETRAHYDROQUINOLINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2003-11-05 EP disclosed
WO-2002050041-A1 DIHYDROINDOLE AND TETRAHYDROQUINOLINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2002-06-27 WO disclosed