SCHEMBL875038

SCHEMBL875038

CC(Sc1ccc(N)cc1)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.46
LMNA P02545 2/20 0.46
EPHX1 P07099 1/20 0.42
HSD17B10 Q99714 2/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
ALDH1A1 P00352 3/20 0.40
HPGD P15428 2/20 0.40
TSHR P16473 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
RXFP1 Q9HBX9 2/20 0.40
MAP2K7 O14733 1/20 0.40
ELANE P08246 1/20 0.40
CDC25A P30304 1/20 0.40
CDC25B P30305 1/20 0.40
PRNP P04156 1/20 0.40
MAPK10 P53779 1/20 0.40
HTT P42858 1/20 0.40
CYP3A4 P08684 1/20 0.39
MAPK1 P28482 1/20 0.39

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
SCHEMBL10455022 0.82 KDM4E (0.47) KDM4ELMNAEPHX1HSD17B10CYP2C9
SCHEMBL5110593 0.82 GAA (0.53) KDM4ELMNAHSD17B10CYP2C9CYP2C19
SCHEMBL10455020 0.82 KDM4E (0.47) KDM4ELMNAEPHX1HSD17B10CYP2C9
SCHEMBL11574943 0.82 HPGD (0.57) KDM4ELMNAHSD17B10CYP2C9CYP2C19
SCHEMBL1931354 0.81 KDM4E (0.51) KDM4ELMNAEPHX1HSD17B10ALDH1A1
SCHEMBL7398296 0.80 CYP2C9 (0.66) KDM4ELMNAHSD17B10CYP2C9CYP2C19
SCHEMBL7048451 0.80 MEN1 (0.51) KDM4ELMNAEPHX1HSD17B10CYP2C9
SCHEMBL2553786 0.78 HPGD (0.55) KDM4ELMNAHSD17B10CYP2C9CYP2C19
SCHEMBL1178110 0.78 EPHX1 (0.45) KDM4ELMNAEPHX1ALDH1A1NPSR1
SCHEMBL11516166 0.77 ALDH1A1 (0.51) KDM4ELMNAEPHX1ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140148459-A1 MATRIX METALLOPROTEINASE INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2014-05-29 US 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-20140148459-A1 MATRIX METALLOPROTEINASE INHIBITORS MMP9, MMP12, MMP10 KDM4E 4398/4885LMNA 2726/4885EPHX1 1354/4885

“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.