SCHEMBL2026261

SCHEMBL2026261

O=CCC(Cc1ccco1)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 1/20 0.46
SLC1A2 P43004 1/20 0.46
SLC1A1 P43005 1/20 0.46
KMT2A Q03164 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
PKM P14618 2/20 0.40
POLB P06746 2/20 0.40
PTPN1 P18031 1/20 0.40
PTPN7 P35236 1/20 0.40
BLM P54132 1/20 0.40
ESR2 Q92731 1/20 0.40
ALDH1A1 P00352 2/20 0.39
ATM Q13315 1/20 0.38
MEN1 O00255 1/20 0.38
ALOX5 P09917 1/20 0.38
CYP1A2 P05177 1/20 0.38
MAPT P10636 1/20 0.38
RAB9A P51151 2/20 0.37
GAA P10253 1/20 0.37
NPC1 O15118 1/20 0.37

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
SCHEMBL3931357 0.80 NR4A2 (0.47) SLC1A3SLC1A2SLC1A1KMT2AL3MBTL1
SCHEMBL11070093 0.80 CPA1 (0.56) SLC1A3SLC1A2SLC1A1KMT2AL3MBTL1
SCHEMBL22982167 0.80 FOLH1 (0.56) SLC1A3SLC1A2SLC1A1
SCHEMBL1532410 0.77 TDP1 (0.47) SLC1A3SLC1A2SLC1A1KMT2AL3MBTL1
SCHEMBL28358733 0.77 ALDH1A1 (0.46) SLC1A3SLC1A2SLC1A1KMT2AL3MBTL1
SCHEMBL30401703 0.77 CYP2C19 (0.50) SLC1A3SLC1A2SLC1A1KMT2AL3MBTL1
SCHEMBL11232248 0.77 SLC1A3 (0.50) SLC1A3SLC1A2SLC1A1KMT2AL3MBTL1
SCHEMBL2265386 0.76 SLC1A1 (0.59) SLC1A3SLC1A2SLC1A1ALOX5
SCHEMBL18339092 0.76 NPC1 (0.42) SLC1A3SLC1A2SLC1A1KMT2AL3MBTL1
SCHEMBL22551032 0.75 MAPK1 (0.47) SLC1A3SLC1A2SLC1A1KMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110230477-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING METABOLIC DISORDERS EUROSCREEN S.A. (BE) 2011-09-22 US disclosed
WO-2011076732-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING GASTROINTESTINAL DISORDERS EUROSCREEN S.A. (BE) 2011-06-30 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-20110230477-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING METABOLIC DISORDERS CPT1A, LIPC, PC SLC1A3 2151/4885SLC1A2 2094/4885SLC1A1 1941/4885

“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.