SCHEMBL4371373

SCHEMBL4371373

CC(=O)N1c2cc(OCc3ccccn3)c(N)cc2C(C)(c2ccccc2)CC1(C)C

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FSHR P23945 18/20 0.56
TSHR P16473 1/20 0.52
MEN1 O00255 1/20 0.51
ADRB2 P07550 1/20 0.51
KMT2A Q03164 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51

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
SCHEMBL4369531 0.87 FSHR (0.58) FSHRTSHRMEN1ADRB2KMT2A
SCHEMBL3527520 0.85 FSHR (0.54) FSHRTSHRMEN1ADRB2KMT2A
SCHEMBL3704579 0.84 FSHR (0.67) FSHRTSHRMEN1ADRB2KMT2A
SCHEMBL4370728 0.84 FSHR (0.61) FSHRTSHRMEN1ADRB2KMT2A
SCHEMBL3523693 0.81 FSHR (0.58) FSHRTSHRMEN1ADRB2KMT2A
SCHEMBL3526977 0.81 FSHR (0.58) FSHRTSHRMEN1ADRB2KMT2A
SCHEMBL3397967 0.81 FSHR (0.66) FSHRTSHRMEN1ADRB2KMT2A
SCHEMBL3529051 0.79 FSHR (0.54) FSHRTSHRMEN1ADRB2KMT2A
SCHEMBL3528816 0.78 FSHR (0.53) FSHRTSHRMEN1ADRB2KMT2A
SCHEMBL3527545 0.77 FSHR (0.71) FSHRTSHRMEN1ADRB2KMT2A

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
EP-1578726-B1 TETRAHYDROQUINOLINE DERIVATIVES ORGANON NV (NL) 2009-02-25 EP disclosed