SCHEMBL7741261

SCHEMBL7741261

COCO[C@@H](CNC(=O)c1ccc(-c2cc3ccccc3o2)cc1)CC(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP12 P39900 1/20 0.48
MMP13 P45452 1/20 0.48
ADCY6 O43306 3/20 0.47
ADCY3 O60266 3/20 0.47
ADCY9 O60503 3/20 0.47
ADCY5 O95622 3/20 0.47
ADCY8 P40145 3/20 0.47
GCGR P47871 3/20 0.47
ADCY7 P51828 3/20 0.47
ADCY2 Q08462 3/20 0.47
ADCY1 Q08828 3/20 0.47
ADCY4 Q8NFM4 3/20 0.47
ALDH1A1 P00352 3/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
KDM4E B2RXH2 2/20 0.43
NPC1 O15118 1/20 0.43
NFKB1 P19838 1/20 0.43
NPY1R P25929 1/20 0.43
RAB9A P51151 1/20 0.43

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
SCHEMBL7741045 1.00 MMP12 (0.48) MMP12MMP13ADCY6ADCY3ADCY9
SCHEMBL7741047 1.00 MMP12 (0.48) MMP12MMP13ADCY6ADCY3ADCY9
SCHEMBL7734836 0.91 HDAC6 (0.42) MMP12MMP13ADCY6ADCY3ADCY9
SCHEMBL7734842 0.91 HDAC6 (0.42) MMP12MMP13ADCY6ADCY3ADCY9
SCHEMBL7739540 0.91 HDAC6 (0.42) MMP12MMP13ADCY6ADCY3ADCY9
SCHEMBL7739507 0.81 MMP12 (0.64) MMP12MMP13ADCY6ADCY3ADCY9
SCHEMBL7740347 0.81 MMP12 (0.64) MMP12MMP13ADCY6ADCY3ADCY9
SCHEMBL7739512 0.81 MMP12 (0.64) MMP12MMP13ADCY6ADCY3ADCY9
SCHEMBL7735404 0.80 HDAC6 (0.41) MMP12MMP13ADCY6ADCY3ADCY9
SCHEMBL7735408 0.80 HDAC6 (0.41) MMP12MMP13ADCY6ADCY3ADCY9

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
US-6420427-B1 PREVENTION AND/OR TREATMENT OF RHEUMATOID DISEASES, ARTHROSTEITIS, UNUSUAL BONE RESORPTION, OSTEOPOROSIS, PERIODONTITIS, INTERSTITIAL NEPHRITIS, ARTERIOSCLEROSIS, PULMONARY EMPHYSEMA, CIRRHOSIS, CORNEA INJURY ONO PHARMACEUTICAL CO., LTD. (JP) 2002-07-16 US claimed
EP-1024134-A1 AMINOBUTANOIC ACID DERIVATIVES ONO PHARMACEUTICAL CO., LTD. (JP) 2000-08-02 EP claimed
US-6420427-B1 PREVENTION AND/OR TREATMENT OF RHEUMATOID DISEASES, ARTHROSTEITIS, UNUSUAL BONE RESORPTION, OSTEOPOROSIS, PERIODONTITIS, INTERSTITIAL NEPHRITIS, ARTERIOSCLEROSIS, PULMONARY EMPHYSEMA, CIRRHOSIS, CORNEA INJURY ONO PHARMACEUTICAL CO., LTD. (JP) 2002-07-16 US disclosed
EP-1024134-A1 AMINOBUTANOIC ACID DERIVATIVES ONO PHARMACEUTICAL CO., LTD. (JP) 2000-08-02 EP disclosed