SCHEMBL388620

SCHEMBL388620

CC(C)(C)N(CCNS(=O)(=O)c1ccc(-c2ccc(O)cc2)cc1)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 3/20 0.44
MMP9 P14780 3/20 0.44
ADAMTS4 O75173 1/20 0.44
MMP1 P03956 3/20 0.44
MMP3 P08254 2/20 0.44
MMP7 P09237 2/20 0.44
MMP13 P45452 2/20 0.44
ALDH1A1 P00352 4/20 0.43
LMNA P02545 2/20 0.43
HPGD P15428 2/20 0.43
KDM4E B2RXH2 1/20 0.43
NPC1 O15118 1/20 0.43
MAPT P10636 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MMP12 P39900 2/20 0.43
GAA P10253 1/20 0.43
HDAC1 Q13547 1/20 0.42
HDAC2 Q92769 1/20 0.42
UQCRB P14927 1/20 0.42

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
SCHEMBL387476 0.85 SIGMAR1 (0.57) MMP2MMP9MMP1MMP3MMP7
SCHEMBL3412319 0.76 CA1 (0.43) ALDH1A1TSHRNPSR1MAPK1GFER
SCHEMBL7028080 0.74 TSHR (0.71) ALDH1A1TSHRNPSR1MAPK1GFER
SCHEMBL15915623 0.74 RECQL (0.53) POLB
SCHEMBL3603937 0.74 MMP2 (0.51) MMP2MMP9ADAMTS4MMP1MMP3
SCHEMBL3413342 0.73 IKBKB (0.59)
SCHEMBL3416582 0.73 IKBKB (0.58)
SCHEMBL1028215 0.72 KMT2A (0.55) MMP2MMP9MMP1MMP13ALDH1A1
SCHEMBL1028213 0.72 KMT2A (0.55) MMP2MMP9MMP1MMP13ALDH1A1
SCHEMBL6100149 0.72 SFRP1 (0.52)

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120077812-A1 BICYCLIC COMPOUNDS AND USE AS ANTIDIABETICS FANG JING (US) 2012-03-29 US disclosed
US-8101634-B2 Bicyclic compounds and use as antidiabetics GLAXOSMITHKLINE LLC (US) 2012-01-24 US disclosed
EP-2325182-A1 Bicyclic compounds and use as antidiabetics Glaxosmithkline LLC (US) 2011-05-25 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120077812-A1 BICYCLIC COMPOUNDS AND USE AS ANTIDIABETICS GPR119, GOT2, PC MMP2 3123/4885MMP9 4394/4885ADAMTS4 3347/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.