SCHEMBL7916340

SCHEMBL7916340

O=C(OCc1ccccc1)[C@@]1(NS(=O)(=O)c2ccc(Oc3ccc(F)cc3)cc2)C[C@H]2CC[C@@H](C1)O2

nearest known ligand 0.67

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 18/20 0.67
MMP13 P45452 18/20 0.67
MMP2 P08253 2/20 0.67
MMP3 P08254 2/20 0.67
MMP9 P14780 2/20 0.67
MMP8 P22894 2/20 0.67
MMP12 P39900 1/20 0.47
MMP14 P50281 1/20 0.47
AR P10275 1/20 0.42
FFAR1 O14842 1/20 0.41
FFAR4 Q5NUL3 1/20 0.41

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
SCHEMBL6872351 1.00 MMP1 (0.67) MMP1MMP13MMP2MMP3MMP9
SCHEMBL7000530 0.87 MMP1 (0.70) MMP1MMP13MMP2MMP3MMP9
SCHEMBL7000532 0.87 MMP1 (0.70) MMP1MMP13MMP2MMP3MMP9
SCHEMBL6998188 0.87 MMP1 (0.71) MMP1MMP13MMP2MMP3MMP9
SCHEMBL6998192 0.87 MMP1 (0.71) MMP1MMP13MMP2MMP3MMP9
SCHEMBL6809628 0.84 MMP1 (0.63) MMP1MMP13MMP2MMP3MMP9
SCHEMBL6696963 0.84 MMP1 (0.63) MMP1MMP13MMP2MMP3MMP9
SCHEMBL7004525 0.84 MMP1 (0.80) MMP1MMP13MMP2MMP3MMP9
SCHEMBL4048453 0.84 MMP1 (0.80) MMP1MMP13MMP2MMP3MMP9
SCHEMBL6866682 0.84 MMP1 (0.65) MMP1MMP13MMP2MMP3MMP9

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-6229025-B1 MICHAEL ADDITION TO PROPIOLATES PFIZER INC 2001-05-08 US disclosed
EP-0949244-A2 Process for preparing hydroxamic acids Pfizer Products Inc. (US) 1999-10-13 EP disclosed