SCHEMBL6995225

SCHEMBL6995225

O=C(NOCc1ccccc1)[C@@]1(CSc2ccc(Oc3ccc(F)cc3)cc2)C[C@H]2CC[C@@H](C1)O2

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 2/20 0.42
MMP13 P45452 2/20 0.42
MMP2 P08253 1/20 0.42
MMP3 P08254 1/20 0.42
MMP9 P14780 1/20 0.42
MMP8 P22894 1/20 0.42
EPHX2 P34913 3/20 0.35
LTA4H P09960 2/20 0.35
GPR34 Q9UPC5 2/20 0.34
ALDH1A1 P00352 3/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
LMNA P02545 2/20 0.33
GAA P10253 1/20 0.33
HTT P42858 1/20 0.33
CHRM4 P08173 1/20 0.33
KDM1A O60341 1/20 0.33
MAOA P21397 1/20 0.33

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
SCHEMBL6995230 1.00 MMP1 (0.42) MMP1MMP13MMP2MMP3MMP9
SCHEMBL7993340 0.83 MMP1 (0.56) MMP1MMP13MMP2MMP3MMP9
SCHEMBL6998206 0.83 MMP1 (0.50) MMP1MMP13MMP2MMP3MMP9
SCHEMBL6998203 0.83 MMP1 (0.50) MMP1MMP13MMP2MMP3MMP9
SCHEMBL6995243 0.82 MMP1 (0.46) MMP1MMP13MMP2MMP3MMP9
SCHEMBL7993451 0.79 MMP1 (0.45) MMP1MMP13MMP2MMP3MMP9
SCHEMBL7000530 0.78 MMP1 (0.70) MMP1MMP13MMP2MMP3MMP9
SCHEMBL7000532 0.78 MMP1 (0.70) MMP1MMP13MMP2MMP3MMP9
SCHEMBL7001941 0.74 MMP1 (0.56) MMP1MMP13MMP2MMP3MMP9
SCHEMBL6998853 0.74 MMP1 (0.56) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1070069-B1 BICYCLIC HYDROXAMIC ACID DERIVATIVES PFIZER PROD INC (US) 2003-07-16 EP disclosed
EP-1070069-A1 BICYCLIC HYDROXAMIC ACID DERIVATIVES Pfizer Products Inc. (US) 2001-01-24 EP disclosed
US-6110964-A FOR TREATING ARTHRITIS, INFLAMMATORY BOWEL DISEASE, CROHN'S DISEASE, EMPHYSEMA, ACUTE RESPIRATORY DISTRESS SYNDROME, ASTHMA CHRONIC OBSTRUCTIVE PULMONARY DISEASE, ALZHEIMER'S DISEASE, ORGAN TRANSPLANT TOXICITY, CACHEXIA, CANCER PFIZER INC. (US) 2000-08-29 US disclosed
WO-1999052910-A1 BICYCLIC HYDROXAMIC ACID DERIVATIVES PFIZER PRODUCTS INC. (US) 1999-10-21 WO disclosed