SCHEMBL7993340

SCHEMBL7993340

O=C(NO)C1(CSc2ccc(Oc3ccc(F)cc3)cc2)CC2CCC(C1)O2

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 14/20 0.56
MMP13 P45452 13/20 0.56
MMP2 P08253 4/20 0.56
MMP3 P08254 3/20 0.56
MMP9 P14780 3/20 0.56
MMP8 P22894 2/20 0.56
MMP12 P39900 1/20 0.39
MMP14 P50281 1/20 0.39
ALDH1A1 P00352 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
EPHX2 P34913 1/20 0.38

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
SCHEMBL6998853 0.89 MMP1 (0.56) MMP1MMP13MMP2MMP3MMP9
SCHEMBL7001941 0.89 MMP1 (0.56) MMP1MMP13MMP2MMP3MMP9
SCHEMBL6995243 0.88 MMP1 (0.46) MMP1MMP13MMP2MMP3MMP9
SCHEMBL7993451 0.87 MMP1 (0.45) MMP1MMP13MMP2MMP3MMP9
SCHEMBL6995225 0.83 MMP1 (0.42) MMP1MMP13MMP2MMP3MMP9
SCHEMBL6995230 0.83 MMP1 (0.42) MMP1MMP13MMP2MMP3MMP9
SCHEMBL7304697 0.81 MMP1 (0.54) MMP1MMP13MMP2MMP3MMP9
SCHEMBL7000007 0.80 MMP13 (0.66) MMP1MMP13MMP2MMP3MMP9
SCHEMBL6995857 0.76 MMP1 (0.46) MMP1MMP13MMP2MMP3MMP9
SCHEMBL8076215 0.73 MMP1 (0.70) 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-6288246-B1 REACTION OF HYDROXYLAMINE WITH ALKYLSILYL HALIDE, HYDROLYSIS WITH ACID PFIZER INC 2001-09-11 US disclosed
EP-0949244-A2 Process for preparing hydroxamic acids Pfizer Products Inc. (US) 1999-10-13 EP disclosed