SCHEMBL6985845

SCHEMBL6985845

NCCCCCCCCNC=O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADH1B P00325 3/20 0.56
ADH1A P07327 3/20 0.56
ADH7 P40394 3/20 0.56
ADH1C P00326 2/20 0.56
EPHX1 P07099 1/20 0.56
ADH4 P08319 1/20 0.56
CA12 O43570 4/20 0.52
CA2 P00918 4/20 0.52
CA4 P22748 4/20 0.52
CA6 P23280 4/20 0.52
CA5A P35218 4/20 0.52
CA7 P43166 4/20 0.52
CA9 Q16790 4/20 0.52
CA14 Q9ULX7 4/20 0.52
CA5B Q9Y2D0 4/20 0.52
CA1 P00915 3/20 0.52
CA3 P07451 3/20 0.52
F13A1 P00488 2/20 0.52
CYP1A2 P05177 2/20 0.52
ALOX15 P16050 2/20 0.52

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
SCHEMBL7246326 1.00 ADH1B (0.56) ADH1BADH1AADH7ADH1CEPHX1
SCHEMBL2744454 1.00
SCHEMBL9556470 1.00 ADH1B (0.56) ADH1BADH1AADH7ADH1CEPHX1
SCHEMBL7238378 1.00 ADH1B (0.56) ADH1BADH1AADH7ADH1CEPHX1
SCHEMBL5255853 1.00 ADH1B (0.56) ADH1BADH1AADH7ADH1CEPHX1
SCHEMBL1314338 0.97
SCHEMBL790241 0.92
Hydrochloric Acid SCHEMBL11441097 0.89
Iodide SCHEMBL27646334 0.89
SCHEMBL11322360 0.85 ADH1B (0.72) ADH1BADH1AADH7ADH1CEPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4396613-A DEMYCINOSYLTYLOSIN, ANTIBIOTICS ELI LILLY AND COMPANY (US) 1983-08-02 US claimed
EP-1027351-B1 PHENANTHROLINE DERIVATIVES FIBROGEN INC (US) 2003-12-03 EP disclosed
CN-1440382-A Method for separating ammoniac BASF AG (DE) 2003-09-03 CN disclosed
US-20030143146-A1 Method for separating ammoniac BASF AKTIENGESELLSCHAFT (DE) 2003-07-31 US 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 ADH1B 1403/4885ADH1A 293/4885ADH7 2343/4885

“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.