SCHEMBL7052320

SCHEMBL7052320

COc1ccc(CCn2c(=O)[nH]c3ccc(C(=O)O)cc3c2=O)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN5 P54829 1/20 0.55
MAPT P10636 4/20 0.52
SMN1; SMN2 Q16637 4/20 0.52
TP53 P04637 3/20 0.52
LMNA P02545 2/20 0.52
THRB P10828 1/20 0.52
MAPK1 P28482 1/20 0.52
KDM4E B2RXH2 3/20 0.52
ALDH1A1 P00352 5/20 0.51
GAA P10253 4/20 0.51
HSD17B10 Q99714 3/20 0.51
HPGD P15428 2/20 0.51
CA12 O43570 1/20 0.51
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
NPSR1 Q6W5P4 2/20 0.49
CYP3A4 P08684 2/20 0.49
CYP2C9 P11712 2/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49

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
SCHEMBL6244847 0.89 KDM4E (0.66) PTPN5MAPTSMN1; SMN2TP53LMNA
SCHEMBL7020296 0.87 MAPT (0.57) MAPTSMN1; SMN2TP53MAPK1KDM4E
SCHEMBL6234637 0.87 MAPT (0.69) MAPTSMN1; SMN2TP53KDM4EALDH1A1
SCHEMBL6238938 0.85 KMT2A (0.56) MAPTSMN1; SMN2TP53LMNAKDM4E
SCHEMBL6431684 0.85 MAPT (0.52) MAPTSMN1; SMN2TP53LMNAKDM4E
SCHEMBL7019254 0.83 ALDH1A1 (0.48) MAPTSMN1; SMN2TP53KDM4EALDH1A1
SCHEMBL7191192 0.82 ALDH1A1 (0.60) MAPTSMN1; SMN2TP53KDM4EALDH1A1
SCHEMBL7634269 0.81 ALDH1A1 (0.49) MAPTSMN1; SMN2TP53LMNAMAPK1
SCHEMBL4254375 0.80 ALDH1A1 (0.72) MAPTSMN1; SMN2TP53LMNAKDM4E
SCHEMBL6510914 0.79 KDM4E (0.65) MAPTSMN1; SMN2TP53LMNAKDM4E

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-20030078276-A1 Matrix metalloproteinase inhibitors ANDRIANJARA CHARLES (FR) 2003-04-24 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-20030078276-A1 Matrix metalloproteinase inhibitors MMP13, MMP25, MMP12 PTPN5 3656/4885MAPT 2607/4885SMN1; SMN2 1745/4885

“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.