SCHEMBL5515375

SCHEMBL5515375

CCCC(CCCOc1ccccc1)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.59
PPARG P37231 6/20 0.53
ALOX5 P09917 5/20 0.53
PPARA Q07869 5/20 0.53
PTGES O14684 4/20 0.53
CHRM1 P11229 1/20 0.52
AKR1A1 P14550 1/20 0.52
CHRM3 P20309 1/20 0.52
HTR2A P28223 1/20 0.52
HTR2C P28335 1/20 0.52
ADRA1A P35348 1/20 0.52
HRH1 P35367 1/20 0.52
DRD3 P35462 1/20 0.52
SLC6A3 Q01959 1/20 0.52
HDAC1 Q13547 1/20 0.52
HDAC2 Q92769 1/20 0.52
LTA4H P09960 2/20 0.50
RECQL P46063 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.47
KCNA3 P22001 1/20 0.47

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
SCHEMBL15514507 0.86 ALOX5 (0.53) TDP1PPARGALOX5PPARAPTGES
Trifluoroacetic Acid SCHEMBL1742314 0.86 ALOX5 (0.53) TDP1PPARGALOX5PPARAPTGES
SCHEMBL7363754 0.83 PPARG (0.55) TDP1PPARGALOX5PPARARECQL
SCHEMBL13431004 0.81 TDP1 (0.52) TDP1PPARGALOX5PPARAPTGES
SCHEMBL23366616 0.81 TDP1 (0.52) TDP1HDAC1HDAC2RECQLL3MBTL1
SCHEMBL4550642 0.81 ALOX5 (0.53) TDP1PPARGALOX5PPARAPTGES
SCHEMBL9069705 0.80 PKM (0.66) TDP1PPARGPPARAL3MBTL1PARP10
SCHEMBL10361086 0.80 TDP1 (0.55) TDP1PPARGALOX5PPARACHRM1
SCHEMBL7754950 0.80 TDP1 (0.54) TDP1PPARGALOX5PPARAPTGES
SCHEMBL755408 0.80 PPARA (0.48) TDP1PPARGALOX5PPARAPTGES

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050267168-A1 Pentanoic acid derivatives ONO PHARMACEUTICAL CO., LTD. 2005-12-01 US claimed
US-20030096802-A1 Pentanoic acid derivatives ONO PHARMACEUTICAL CO., LTD. 2003-05-22 US claimed
US-6201021-B1 TREATMENT OF DISEASES INDUCED BY REACTIVE ASTROCYTES ONO PHARMACEUTICAL CO., LTD. (JP) 2001-03-13 US claimed
EP-0632008-B1 Pentanoic acid derivatives ONO PHARMACEUTICAL CO (JP) 1998-02-04 EP claimed
EP-0632008-A1 Pentanoic acid derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1995-01-04 EP claimed
US-8569058-B2 Nerve regeneration promoters ONO PHARMACEUTICAL CO., LTD. (JP) 2013-10-29 US disclosed
US-7569608-B2 Pentanoic acid derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 2009-08-04 US disclosed
US-7569609-B2 Pentanoic acid derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 2009-08-04 US disclosed
US-20070043114-A1 Nerve regeneration promoters ONO PHARMACEUTICAL CO., LTD. (JP) 2007-02-22 US disclosed
US-7176240-B2 Pentanoic acid derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 2007-02-13 US disclosed
EP-1685832-A1 NERVE REGENERATION PROMOTERS ONO PHARMACEUTICAL CO., LTD. (JP) 2006-08-02 EP 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 (3 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-20050267168-A1 Pentanoic acid derivatives FFAR3, FFAR1, HCAR3 TDP1 3237/4885PPARG 510/4885ALOX5 568/4885
US-20070043114-A1 Nerve regeneration promoters BDNF, NGF, GAP43 TDP1 359/4885PPARG 1726/4885ALOX5 2494/4885
US-20030096802-A1 Pentanoic acid derivatives FFAR3, FPR1, FPR3 TDP1 1460/4885PPARG 932/4885ALOX5 425/4885

“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.