SCHEMBL27765327

SCHEMBL27765327

O=C(NO)c1nnc(N2CCC(Oc3cc(F)ccc3Br)CC2)s1

nearest known ligand 0.60

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SCD O00767 16/20 0.60
SCD5 Q86SK9 1/20 0.49

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
SCHEMBL473036 0.88 SCD (0.62) SCDSCD5
SCHEMBL473034 0.82 SCD (0.59) SCDSCD5
SCHEMBL473035 0.82 SCD (0.59) SCDSCD5
SCHEMBL4743748 0.81 SCD (0.48) SCD
SCHEMBL473031 0.81 SCD (0.62) SCDSCD5
SCHEMBL4094322 0.80 SCD (0.54) SCDSCD5
SCHEMBL3609071 0.79 SCD (0.70) SCDSCD5
SCHEMBL3606620 0.78 SCD (0.64) SCDSCD5
SCHEMBL2945529 0.78 SCD (0.58) SCDSCD5
SCHEMBL2945534 0.78 SCD (0.58) SCDSCD5

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
CN-101589039-B Azacycloalkane derivatives as inhibitors of stearoyl-coenzyme A delta-9 desaturase MERCK FROSST CANADA LTD 2012-09-05 CN disclosed
CN-101589039-A Azacycloalkane derivatives as inhibitors of stearoyl-coenzyme A delta-9 desaturase MERCK FROSST CANADA LTD (CA) 2009-11-25 CN disclosed