SCHEMBL7723110

SCHEMBL7723110

CCCCN(C(=O)O)N(CC)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.43
CA1 P00915 2/20 0.43
CA9 Q16790 2/20 0.43
MMP1 P03956 1/20 0.39
MMP2 P08253 1/20 0.39
MMP3 P08254 1/20 0.39
MMP8 P22894 1/20 0.39
AKR1B1 P15121 1/20 0.37
KDM5A P29375 1/20 0.37
KDM4C Q9H3R0 1/20 0.37
GAA P10253 1/20 0.36
HPGD P15428 1/20 0.36
GPR84 Q9NQS5 7/20 0.36
PPARG P37231 7/20 0.36
PPARD Q03181 7/20 0.36
PPARA Q07869 7/20 0.36
HDAC11 Q96DB2 5/20 0.36
TSHR P16473 4/20 0.36
PTPN1 P18031 3/20 0.36
ALDH1A1 P00352 2/20 0.36

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
SCHEMBL11337417 0.93 CA12 (0.46) CA12CA1CA9MMP1MMP2
SCHEMBL5784743 0.82 FFAR3 (0.41) MMP1MMP2MMP3MMP8AKR1B1
SCHEMBL3324870 0.81 CA12 (0.41) CA12CA1CA9MMP1MMP2
SCHEMBL5134075 0.79 CA12 (0.40) CA12CA1CA9MMP1MMP2
SCHEMBL11330893 0.76 CA12 (0.42) CA12CA1CA9AKR1B1HPGD
SCHEMBL7727108 0.74 CA1 (0.36) CA12CA1CA9MMP1MMP2
SCHEMBL969160 0.73 CA12 (0.61) CA12CA1CA9MMP1MMP2
SCHEMBL2461092 0.73 CA12 (0.36) CA12CA1CA9HPGDTSHR
SCHEMBL751749 0.72 CA12 (0.58) CA12CA1CA9MMP1MMP2
SCHEMBL455742 0.72 CA12 (0.46) CA12CA1CA9MMP1MMP2

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-6398938-B2 WHERE THE ANODICALLY POLARIZED LAYER ON THE ANODE SUPPORT IS FORMED IN SITU BY PRECOATING; EXCLUDES THE OXIDATION OF PHOSPHONOMETHYLIMINODIACETIC ACID; HIGH YIELDS BASF AKTIENGESELLSCHAFT (DE) 2002-06-04 US claimed
US-20010019020-A1 Process for electrochemical oxidation of organic compounds BASF AKTIENGESELLSCHAFT (DE) 2001-09-06 US claimed