SCHEMBL7218495

SCHEMBL7218495

CCCCCN(C)CCCCOc1ccc2c(c1)CCN2C(=O)Oc1ccc(Cl)cc1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 2/20 0.41
ADRB2 P07550 2/20 0.41
ADRB1 P08588 2/20 0.41
ADRB3 P13945 2/20 0.41
THRB P10828 4/20 0.41
THRA P10827 2/20 0.41
GAA P10253 1/20 0.40
DRD2 P14416 1/20 0.39
DRD4 P21917 1/20 0.39
TP53 P04637 1/20 0.39
MAPT P10636 3/20 0.39
MCHR1 Q99705 1/20 0.39
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.38
FDPS P14324 1/20 0.38

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
SCHEMBL7218398 0.93 MAPT (0.46) TP53MAPTLMNAPOLB
SCHEMBL7217166 0.89 ADRB2 (0.38) NOTUMADRB2ADRB1ADRB3THRB
SCHEMBL5638140 0.88 LSS (0.51)
SCHEMBL5639788 0.84 NOTUM (0.43) NOTUMTHRBDRD2DRD4TP53
SCHEMBL5638012 0.84 MAOB (0.43) TP53MAPTLMNA
SCHEMBL5639200 0.83 LSS (0.49)
SCHEMBL5639077 0.82 LSS (0.51)
SCHEMBL5637520 0.82 LSS (0.51)
SCHEMBL5638655 0.80 FDPS (0.37) NOTUMTHRBDRD2DRD4TP53
SCHEMBL5638502 0.80 LSS (0.46) TP53MAPTLMNA

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