SCHEMBL6843398

SCHEMBL6843398

O=C(O)c1ccc(Cc2c(O)cc3ccc(C(=O)OCc4cccnc4)cc3c2O)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.46
LMNA P02545 2/20 0.46
TDP1 Q9NUW8 1/20 0.46
HDAC1 Q13547 5/20 0.39
HDAC3 O15379 1/20 0.39
HDAC4 P56524 1/20 0.39
HDAC7 Q8WUI4 1/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC10 Q969S8 1/20 0.39
HDAC11 Q96DB2 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
HDAC9 Q9UKV0 1/20 0.39
HDAC5 Q9UQL6 1/20 0.39
ALDH1A1 P00352 2/20 0.38
EGFR P00533 1/20 0.38
TBXAS1 P24557 3/20 0.38
KDM4C Q9H3R0 1/20 0.37
KDM4E B2RXH2 1/20 0.36
VKORC1 Q9BQB6 1/20 0.36

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
SCHEMBL6195785 0.89 LMNA (0.48) KMT2ALMNATDP1ALDH1A1KDM4E
SCHEMBL6845496 0.88 MAPT (0.42) KMT2ALMNATDP1ALDH1A1TBXAS1
SCHEMBL6843319 0.83 SRD5A2 (0.43) KMT2ALMNAALDH1A1KDM4E
SCHEMBL6842430 0.83 MAPT (0.44) KMT2ALMNAALDH1A1
SCHEMBL6843440 0.83 RXRA (0.43) KMT2ALMNATDP1ALDH1A1
SCHEMBL6838144 0.83 NR4A2 (0.43) KMT2ALMNAALDH1A1
SCHEMBL6843367 0.83 RXRA (0.43) KMT2ALMNATDP1ALDH1A1KDM4E
SCHEMBL6843371 0.83 GAA (0.51) LMNAALDH1A1
SCHEMBL6845395 0.82 THRB (0.44) ALDH1A1KDM4EVKORC1
SCHEMBL6211990 0.81 PTPN5 (0.47) KMT2AALDH1A1KDM4E

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 KMT2A 4149/4885LMNA 1548/4885TDP1 1549/4885

“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.