SCHEMBL6843371

SCHEMBL6843371

O=C(O)c1ccc(Cc2c(O)cc3ccc(C(=O)NCc4cccnc4)cc3c2O)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.51
ALDH1A1 P00352 3/20 0.48
L3MBTL1 Q9Y468 3/20 0.48
USP2 O75604 2/20 0.48
NPSR1 Q6W5P4 1/20 0.48
CA2 P00918 1/20 0.47
CYP1A2 P05177 2/20 0.47
CYP3A4 P08684 2/20 0.47
TSHR P16473 1/20 0.47
BLM P54132 1/20 0.47
NAMPT P43490 1/20 0.47
LMNA P02545 3/20 0.47
HTT P42858 2/20 0.47
MAPT P10636 1/20 0.47
NR1H4 Q96RI1 1/20 0.47
CYP2C19 P33261 1/20 0.46
TRPV1 Q8NER1 1/20 0.46
CDK1 P06493 1/20 0.46
CDK2 P24941 1/20 0.46
MAPK1 P28482 2/20 0.45

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
SCHEMBL6842635 0.89 NR1H4 (0.59) GAAALDH1A1MAPTNR1H4
SCHEMBL6845364 0.88 NR1H4 (0.50) GAACA2CYP3A4NAMPTLMNA
SCHEMBL6843325 0.83 NR1H4 (0.51) NR1H4
SCHEMBL6843206 0.83 NR1H4 (0.51) ALDH1A1CA2NR1H4
SCHEMBL6843478 0.83 EPHX2 (0.52) ALDH1A1CYP1A2NR1H4CYP2C19
SCHEMBL6843413 0.83 NR1H4 (0.52) ALDH1A1LMNAHTTMAPTNR1H4
SCHEMBL6845318 0.83 NR1H4 (0.51) L3MBTL1LMNAMAPTNR1H4
SCHEMBL6843398 0.83 KMT2A (0.46) ALDH1A1LMNA
SCHEMBL6842678 0.81 MMP13 (0.65) CYP3A4LMNAMAPTNR1H4
SCHEMBL6194796 0.81 NR1H4 (0.59) GAAALDH1A1L3MBTL1USP2NPSR1

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-20040043983-A1 Naphthalene derivatives as matrix metalloproteinase inhibitors LI JIE JACK (US) 2004-03-04 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-20040043983-A1 Naphthalene derivatives as matrix metalloproteinase inhibitors MMP9, MMP8, MMP13 GAA 389/4885ALDH1A1 1588/4885L3MBTL1 4189/4885

“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.