SCHEMBL6843373

SCHEMBL6843373

O=C(O)c1ccc(C(O)c2cc3cc(C(=O)NCc4cccnc4)ccc3cc2O)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.48
MAPK1 P28482 1/20 0.48
NR1H4 Q96RI1 1/20 0.48
GAA P10253 2/20 0.48
L3MBTL1 Q9Y468 3/20 0.48
ALDH1A1 P00352 2/20 0.48
USP2 O75604 2/20 0.48
NPSR1 Q6W5P4 2/20 0.48
POLB P06746 1/20 0.48
HPGD P15428 1/20 0.48
TSHR P16473 2/20 0.47
CA2 P00918 1/20 0.47
CYP1A2 P05177 2/20 0.46
CYP3A4 P08684 2/20 0.46
BLM P54132 1/20 0.46
NAMPT P43490 1/20 0.46
HTT P42858 2/20 0.46
MAPT P10636 1/20 0.46
CYP2C19 P33261 1/20 0.46
MMP13 P45452 1/20 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
SCHEMBL6842637 0.89 NR1H4 (0.61) NR1H4ALDH1A1HPGDMMP13
SCHEMBL6845366 0.88 NR1H4 (0.52) LMNAMAPK1NR1H4GAACA2
SCHEMBL6843399 0.83 KMT2A (0.45) LMNAALDH1A1
SCHEMBL6843326 0.82 NR1H4 (0.55) NR1H4ALDH1A1MMP13
SCHEMBL6843207 0.82 NR1H4 (0.55) NR1H4ALDH1A1HPGDCA2MMP13
SCHEMBL6843480 0.82 NR1H4 (0.55) NR1H4ALDH1A1POLBCYP1A2CYP2C19
SCHEMBL6845319 0.82 NR1H4 (0.55) LMNANR1H4MAPTMMP13
SCHEMBL6843414 0.82 NR1H4 (0.55) LMNANR1H4ALDH1A1HPGDCYP1A2
SCHEMBL6842679 0.82 MMP13 (0.62) LMNANR1H4HPGDCYP3A4NAMPT
SCHEMBL6842474 0.81 NPC1 (0.54) NR1H4L3MBTL1ALDH1A1HPGDMMP13

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 LMNA 1548/4885MAPK1 767/4885NR1H4 1615/4885

“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.