SCHEMBL17803765

SCHEMBL17803765

O=C(NCCC1CC1)c1nnc(N2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)[nH]1

nearest known ligand 0.68

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ SCD O00767 14/20 0.68
▸ DCTPP1 Q9H773 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
SCHEMBL26470 0.82 SCD (0.70) SCDDCTPP1
SCHEMBL1378991 0.81 SCD (1.00) SCDDCTPP1
SCHEMBL4914115 0.80 SCD (0.75) SCDDCTPP1
SCHEMBL4091944 0.80 SCD (0.72) SCD
SCHEMBL13043719 0.80 SCD (0.63) SCDDCTPP1
SCHEMBL17803771 0.79 SCD (0.69) SCDDCTPP1
SCHEMBL3668407 0.78 SCD (0.73) SCDDCTPP1
SCHEMBL3666246 0.78 SCD (0.77) SCDDCTPP1
SCHEMBL1378674 0.78 SCD (0.93) SCDDCTPP1
SCHEMBL24230 0.77 SCD (0.71) SCDDCTPP1

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-9358250-B2 Methods of using SCD1 antagonists GENENTECH, INC. (US) 2016-06-07 — — US disclosed
US-9358250-B2 Methods of using SCD1 antagonists GENENTECH, INC. (US) 2016-06-07 — — US disclosed
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