SCHEMBL6842398

SCHEMBL6842398

O=C(O)c1ccc(Cc2cnc3ccc(C(=O)OCc4ccncc4)cc3c2O)cc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.41
KMT2A Q03164 3/20 0.41
KDM4E B2RXH2 1/20 0.41
CNR2 P34972 1/20 0.40
MEN1 O00255 1/20 0.39
PAX8 Q06710 1/20 0.38
LMNA P02545 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
PIM1 P11309 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
TSHR P16473 1/20 0.36
NAMPT P43490 1/20 0.36
ROCK2 O75116 1/20 0.35

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
SCHEMBL6196320 0.92 LMNA (0.46) MAPTKMT2AKDM4EMEN1LMNA
SCHEMBL6845415 0.90 PAX8 (0.42) MAPTKMT2AKDM4EMEN1PAX8
SCHEMBL6843455 0.90 RXRA (0.44) MAPTKMT2AKDM4EMEN1PAX8
SCHEMBL6843378 0.90 NR4A2 (0.44) MAPTKMT2AMEN1PAX8LMNA
SCHEMBL6844771 0.90 RXRA (0.44) MAPTKMT2AKDM4EMEN1PAX8
SCHEMBL6842986 0.90 NR4A2 (0.44) MAPTKMT2ACNR2MEN1PAX8
SCHEMBL6838199 0.89 RXRA (0.46) MAPT
SCHEMBL6842564 0.89 KMT2A (0.46) KMT2ALMNATDP1TSHR
SCHEMBL6193976 0.88 SMN1; SMN2 (0.48) MAPTKMT2AMEN1PAX8NPC1
SCHEMBL6838124 0.87 TP53 (0.38) MAPTKMT2AMEN1PAX8LMNA

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 MAPT 1745/4885KMT2A 4149/4885KDM4E 1987/4885

“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.