SCHEMBL2209963

SCHEMBL2209963

CCC(=O)c1ccc(OCCCC(=O)O)cc1

nearest known ligand 0.70

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.61
PPARA Q07869 1/20 0.58
PDE4B Q07343 1/20 0.57
NPC1 O15118 2/20 0.56
MAPT P10636 4/20 0.54
MMP1 P03956 1/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
RAB9A P51151 2/20 0.54
HPGD P15428 1/20 0.54
TP53 P04637 1/20 0.53
TSHR P16473 1/20 0.53
HTT P42858 2/20 0.53
ALDH1A1 P00352 2/20 0.52
GAA P10253 2/20 0.52
PLA2G4B P0C869 1/20 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
SCHEMBL30539404 0.95 PPARA (0.65) L3MBTL1PPARAPDE4BNPC1MAPT
SCHEMBL20278587 0.86 GAA (0.67) L3MBTL1NPC1MAPTSMN1; SMN2RAB9A
SCHEMBL10040898 0.86 L3MBTL1 (0.69) L3MBTL1NPC1MAPTMMP1SMN1; SMN2
SCHEMBL17129733 0.86 L3MBTL1 (0.62) L3MBTL1NPC1MAPTMMP1SMN1; SMN2
SCHEMBL9077658 0.85 L3MBTL1 (0.73) L3MBTL1PPARAPDE4BNPC1MMP1
SCHEMBL29089242 0.84 PLA2G4B (0.68) L3MBTL1PPARATP53TSHRGAA
SCHEMBL31448501 0.84 PPARA (0.65) L3MBTL1PPARAGAAPLA2G4B
SCHEMBL3446913 0.83 L3MBTL1 (0.71) L3MBTL1NPC1MAPTMMP1SMN1; SMN2
SCHEMBL6640853 0.83 L3MBTL1 (0.60) L3MBTL1NPC1MAPTMMP1SMN1; SMN2
SCHEMBL445511 0.83 L3MBTL1 (0.76) L3MBTL1PPARAMAPTSMN1; SMN2RAB9A

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
CN-116693416-B Aryloxy aminobenzoic acid derivative, and preparation method and application thereof 桂林医学院 2025-01-07 CN disclosed
CN-116693416-A Aryloxy aminobenzoic acid derivative, and preparation method and application thereof 桂林医学院 2023-09-05 CN disclosed
EP-1389616-B1 3,4-Dihalobenzylpiperidine derivatives and their medical use MITSUBISHI TANABE PHARMA CORP (JP) 2011-07-27 EP disclosed
US-7115635-B2 Benzylpiperidine compound MITSUBISHI PHARMA CORPORATION (JP) 2006-10-03 US disclosed
US-20040158071-A1 Chemokine inhibitors and stability in blood MITSUBISHI PHARMA CORPORATION (JP) 2004-08-12 US disclosed
EP-1389616-A1 NOVEL BENZYLPIPERIDINE COMPOUND Mitsubishi Pharma Corporation (JP) 2004-02-18 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 (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-20040158071-A1 Chemokine inhibitors and stability in blood CCL2, CXCR1, CCR5 L3MBTL1 3984/4885PPARA 1804/4885PDE4B 140/4885

“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.