SCHEMBL7304374

SCHEMBL7304374

CC(C=O)C(=O)N1CCCC1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.40
ALDH1A1 P00352 5/20 0.39
HTT P42858 1/20 0.39
MMP1 P03956 1/20 0.38
MMP2 P08253 1/20 0.38
MMP8 P22894 1/20 0.38
GAA P10253 2/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
DPP7 Q9UHL4 4/20 0.34
DPP4 P27487 4/20 0.34
MAPT P10636 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL7346646 0.98 ALDH1A1 (0.41) HPGDALDH1A1HTTMMP1MMP2
SCHEMBL7299020 0.83 CYP1A2 (0.46) HPGDALDH1A1NPC1
SCHEMBL7303416 0.81 CA2 (0.42) HPGDALDH1A1MEN1KMT2A
SCHEMBL7305057 0.81 DPP4 (0.40) HPGDALDH1A1DPP7DPP4
SCHEMBL7299462 0.81 SMN1; SMN2 (0.47) HPGDALDH1A1HTTGAAMEN1
SCHEMBL5559398 0.80 HPGD (0.39) HPGDALDH1A1HTTMMP1MMP2
SCHEMBL27651069 0.78 ALDH1A1 (0.40) HPGDALDH1A1HTTMMP1MMP2
SCHEMBL1106510 0.75 CHRNB2 (0.46) HPGDALDH1A1HTTMMP1MMP2
SCHEMBL25447805 0.73 ALDH1A1 (0.48) HPGDALDH1A1HTTMMP1MMP2
SCHEMBL21455835 0.73 ALDH1A1 (0.48) HPGDALDH1A1HTTMMP1MMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090042864-A2 PYRAZOLE COMPOUNDS NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2009-02-12 US disclosed
US-6008228-A COMPRISING A MIXTURE OF CARRIER MONOGLYCERIDES OF MEDIUM CHAIN-FATTY ACIDS HOFFMAN-LA ROCHE INC. (US) 1999-12-28 US disclosed
EP-0594540-B1 Antiretroviral acyl compounds CIBA GEIGY AG (CH) 1998-04-01 EP disclosed
EP-0594540-A1 Antiretroviral acyl compounds CIBA-GEIGY AG (CH) 1994-04-27 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-20090042864-A2 PYRAZOLE COMPOUNDS CNR2, CNR1, GPR18 HPGD 1493/4885ALDH1A1 1456/4885HTT 2769/4885

“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.