SCHEMBL7706432

SCHEMBL7706432

CC(C)C[C@H](NC(=O)c1cc2ccccc2o1)C(=O)N[C@H]1CCN(Cc2ccc(Oc3ccccc3)cc2)C1

nearest known ligand 0.78

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 17/20 0.78
CTSK P43235 1/20 0.53
TAS1R3 Q7RTX0 2/20 0.51
TAS1R1 Q7RTX1 2/20 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
SCHEMBL7415352 0.92 UTS2R (0.75) UTS2RCTSKTAS1R3TAS1R1
SCHEMBL7408349 0.87 UTS2R (0.66) UTS2R
SCHEMBL7409676 0.86 UTS2R (0.66) UTS2RCTSKTAS1R3TAS1R1
SCHEMBL7712312 0.85 UTS2R (0.78) UTS2RCTSK
SCHEMBL7409398 0.83 UTS2R (0.79) UTS2RCTSK
SCHEMBL7409679 0.81 UTS2R (0.63) UTS2R
SCHEMBL7408984 0.81 UTS2R (0.65) UTS2R
SCHEMBL7410726 0.81 UTS2R (0.58) UTS2R
SCHEMBL7412384 0.80 UTS2R (0.64) UTS2RCTSK
SCHEMBL7407746 0.80 UTS2R (0.64) UTS2RCTSK

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
US-6369077-B1 OSTEOPOROSIS, PERIODONTITIS, AND ARTHRITIS SMITHKLINE BEECHAM CORPORATION 2002-04-09 US claimed
US-6369077-B1 OSTEOPOROSIS, PERIODONTITIS, AND ARTHRITIS SMITHKLINE BEECHAM CORPORATION 2002-04-09 US disclosed