SCHEMBL7735404

SCHEMBL7735404

O=C(CC(CNC(=O)c1ccc(-c2cc3ccccc3o2)cc1)OCOCc1ccccc1)NO

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 4/20 0.41
HDAC2 Q92769 3/20 0.41
MMP12 P39900 1/20 0.41
MMP13 P45452 1/20 0.41
ADCY6 O43306 3/20 0.40
ADCY3 O60266 3/20 0.40
ADCY9 O60503 3/20 0.40
ADCY5 O95622 3/20 0.40
ADCY8 P40145 3/20 0.40
GCGR P47871 3/20 0.40
ADCY7 P51828 3/20 0.40
ADCY2 Q08462 3/20 0.40
ADCY1 Q08828 3/20 0.40
ADCY4 Q8NFM4 3/20 0.40
P2RY14 Q15391 1/20 0.38
ALDH1A1 P00352 3/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
KDM4E B2RXH2 2/20 0.37
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37

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
SCHEMBL7735408 1.00 HDAC6 (0.41) HDAC6HDAC2MMP12MMP13ADCY6
SCHEMBL7734836 0.88 HDAC6 (0.42) HDAC6HDAC2MMP12MMP13ADCY6
SCHEMBL7739540 0.88 HDAC6 (0.42) HDAC6HDAC2MMP12MMP13ADCY6
SCHEMBL7734842 0.88 HDAC6 (0.42) HDAC6HDAC2MMP12MMP13ADCY6
SCHEMBL7740619 0.81 ADCY6 (0.48) HDAC6HDAC2MMP12MMP13ADCY6
SCHEMBL7739799 0.81 ADCY6 (0.48) HDAC6HDAC2MMP12MMP13ADCY6
SCHEMBL7739803 0.81 ADCY6 (0.48) HDAC6HDAC2MMP12MMP13ADCY6
SCHEMBL7741047 0.80 MMP12 (0.48) HDAC6HDAC2MMP12MMP13ADCY6
SCHEMBL7741045 0.80 MMP12 (0.48) HDAC6HDAC2MMP12MMP13ADCY6
SCHEMBL7741261 0.80 MMP12 (0.48) HDAC6HDAC2MMP12MMP13ADCY6

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