SCHEMBL6974946

SCHEMBL6974946

CCOC(=O)C1C=Nc2c(cccc2[N+](=O)[O-])C1=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.40
KMT2A Q03164 3/20 0.39
CACNA1C Q13936 4/20 0.38
RAB9A P51151 2/20 0.37
NPC1 O15118 1/20 0.37
NFKB1 P19838 1/20 0.37
MAPK1 P28482 1/20 0.37
NFKB2 Q00653 1/20 0.37
RELA Q04206 1/20 0.37
CTSB P07858 1/20 0.37
ALDH1A1 P00352 4/20 0.37
GAA P10253 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CACNA1D Q01668 2/20 0.36
CACNA1F O60840 1/20 0.36
CACNA1S Q13698 1/20 0.36
KDM4E B2RXH2 3/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 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
SCHEMBL6985104 0.83 MAPT (0.38) MAPTKMT2AALDH1A1GAASMN1; SMN2
SCHEMBL6977126 0.81 S100A4 (0.41) MAPTKMT2AALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL4768344 0.76 KDM4E (0.42) MAPTKMT2ARAB9AALDH1A1GAA
SCHEMBL9568083 0.74 MAPT (0.50) MAPTKMT2ACACNA1CRAB9AALDH1A1
SCHEMBL30398320 0.74 MAPT (0.50) MAPTKMT2ACACNA1CRAB9AALDH1A1
SCHEMBL7225483 0.74 ALDH1A1 (0.35) MAPTKMT2ARAB9ANPC1ALDH1A1
SCHEMBL2649285 0.73 RAB9A (0.48) MAPTRAB9AALDH1A1GAASMN1; SMN2
SCHEMBL28560072 0.73 KDM4E (0.40) MAPTKMT2ANFKB1MAPK1NFKB2
SCHEMBL8948751 0.72 MAPT (0.43) MAPTKMT2ACACNA1CRAB9AALDH1A1
SCHEMBL6985195 0.72 ALDH1A1 (0.42) MAPTKMT2ANFKB1MAPK1NFKB2

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1027351-B1 PHENANTHROLINE DERIVATIVES FIBROGEN INC (US) 2003-12-03 EP disclosed
US-20010001101-A1 Phenanthroline derivatives ZENECA LIMITED 2001-05-10 US disclosed
US-6200974-B1 FOR PRODUCING AN ANTI-FIBROPROLIFERATIVE EFFECT ZENECA LIMITED (GB) 2001-03-13 US disclosed
EP-1027351-A1 PHENANTHROLINE DERIVATIVES FIBROGEN, INC. (US) 2000-08-16 EP disclosed
US-5916898-A ANTIFIBROPROLIFERTIVE, ENZYME INHIBITORS OF PYROLYL 4-HYDROXYLASE, ANTIARTHRITIC AGENTS ZENECA LIMITED (GB) 1999-06-29 US disclosed
WO-1999021860-A1 PHENANTHROLINE DERIVATIVES FIBROGEN, INC. (US) 1999-05-06 WO 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-20010001101-A1 Phenanthroline derivatives H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, COL1A1, COL2A1 MAPT 4808/4885KMT2A 1250/4885CACNA1C 19/4885

“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.