SCHEMBL7073725

SCHEMBL7073725

CCOC(=O)CCCC(C(=O)O)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.55
KMT2A Q03164 2/20 0.46
POLB P06746 1/20 0.46
GAA P10253 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
MGAM O43451 1/20 0.44
SI P14410 1/20 0.44
MGAM2 Q2M2H8 1/20 0.44
NR1I2 O75469 1/20 0.44
PGR P06401 1/20 0.44
ADORA3 P0DMS8 1/20 0.44
PTGS2 P35354 1/20 0.44
PDE4D Q08499 1/20 0.44
TDP1 Q9NUW8 3/20 0.42
CYP3A4 P08684 2/20 0.42
TSHR P16473 2/20 0.42
ALDH1A1 P00352 2/20 0.42
ALOX15 P16050 1/20 0.42
HSD17B10 Q99714 1/20 0.42
ATM Q13315 1/20 0.42

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
SCHEMBL11514409 0.92 CYP1A2 (0.52) CYP1A2KMT2APOLBGAANR1I2
SCHEMBL4835509 0.92 CYP1A2 (0.52) CYP1A2KMT2APOLBGAANR1I2
SCHEMBL28022588 0.90 CYP1A2 (0.50) CYP1A2KMT2APOLBGAAL3MBTL1
SCHEMBL11528078 0.88 CYP1A2 (0.55) CYP1A2KMT2APOLBGAAL3MBTL1
SCHEMBL1406699 0.86 CYP1A2 (0.53) CYP1A2KMT2APOLBGAAL3MBTL1
SCHEMBL31079525 0.86 CYP1A2 (0.46) CYP1A2KMT2APOLBGAAL3MBTL1
SCHEMBL23638970 0.84 GPR84 (0.52) CYP1A2KMT2APOLBGAAL3MBTL1
SCHEMBL10673794 0.84 CYP1A2 (0.52) CYP1A2KMT2APOLBGAAL3MBTL1
SCHEMBL22587290 0.82 CYP1A2 (0.50) CYP1A2KMT2APOLBGAAL3MBTL1
SCHEMBL28934763 0.82 CA2 (0.57) CYP1A2KMT2APOLBGAAL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030207889-A1 Hydroxamic and carboxylic acid derivatives having MMP and TNF inhibitory activity OWEN DAVID ALAN (GB) 2003-11-06 US disclosed
US-6566384-B1 For therapy of cancer, inflammation and inflammatory diseases, tissue degeneration, periodontal disease, ophthalmological disease, dermatological disorders, fever, cardiovascular effects, haemorrhage, coagulation and acute phase response DARWIN DISCOVERY LTD. (GB) 2003-05-20 US disclosed
US-6118001-A ANTICANCER AGENT; ANTIARTHRITIC AGENT DARWIN DISCOVERY, LTD. (GB) 2000-09-12 US disclosed
EP-0968182-A1 HYDROXAMIC AND CARBOXYLIC ACID DERIVATIVES HAVING MMP AND TNF INHIBITORY ACTIVITY Darwin Discovery Limited (GB) 2000-01-05 EP disclosed
WO-1998005635-A1 HYDROXAMIC AND CARBOXYLIC ACID DERIVATIVES HAVING MMP AND TNF INHIBITORY ACTIVITY DARWIN DISCOVERY LIMITED (GB) 1998-02-12 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-20030207889-A1 Hydroxamic and carboxylic acid derivatives having MMP and TNF inhibitory activity MMP13, MMP2, MMP9 CYP1A2 2103/4885KMT2A 1581/4885POLB 1684/4885

“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.