SCHEMBL4949335

SCHEMBL4949335

CSCCC(OC(=O)C(C)O)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RNPEP Q9H4A4 1/20 0.44
METAP2 P50579 1/20 0.36
METAP1 P53582 1/20 0.36
FOLH1 Q04609 6/20 0.35
TP53 P04637 1/20 0.34
LMNA P02545 1/20 0.32
CYP2C9 P11712 1/20 0.31
MAPK1 P28482 1/20 0.31
ALDH1A1 P00352 3/20 0.30
NPSR1 Q6W5P4 1/20 0.30
KDM4E B2RXH2 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL28637319 0.87 RNPEP (0.46) RNPEPMETAP2METAP1FOLH1LMNA
SCHEMBL23079505 0.86 RNPEP (0.44) RNPEPMETAP2METAP1FOLH1LMNA
SCHEMBL4953075 0.86 RNPEP (0.44) RNPEPMETAP2METAP1FOLH1LMNA
SCHEMBL4953284 0.83 TP53 (0.39) RNPEPTP53
SCHEMBL4954479 0.83 METAP2 (0.40) METAP2METAP1FOLH1TP53
SCHEMBL4955358 0.81 BHMT (0.36) METAP2METAP1FOLH1TP53
SCHEMBL7399057 0.81 RNPEP (0.44) RNPEPFOLH1
SCHEMBL7399053 0.81 RNPEP (0.44) RNPEPFOLH1
SCHEMBL5328647 0.81 RNPEP (0.43) RNPEPMETAP2METAP1FOLH1LMNA
SCHEMBL28637322 0.80 RNPEP (0.40) RNPEPMETAP2METAP1FOLH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7465471-B2 Palatability of aquaculture feed NOVUS INTERNATIONAL, INC. (US) 2008-12-16 US disclosed
WO-2007147155-A1 POLYOL ESTER COMPOUNDS NOVUS INTERNATIONAL INC. (US) 2007-12-21 WO disclosed
US-20070292485-A1 POLYOL ESTER COMPOUNDS NOVUS INTERNATIONAL INC. (US) 2007-12-20 US disclosed
US-20050215623-A1 Palatability of aquaculture feed NOVUS INTERNATIONAL, INC. (US) 2005-09-29 US disclosed
EP-1531672-A2 ANTIMICROBIAL COMPOSITIONS Novus International, Inc. (US) 2005-05-25 EP disclosed
US-20040175434-A1 Antimicrobial compositions NOVUS INTERNATIONAL, INC. 2004-09-09 US disclosed
WO-2004019683-A2 ANTIMICROBIAL COMPOSITIONS NOVUS INTERNATIONAL, INC. (US) 2004-03-11 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 (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-20070292485-A1 POLYOL ESTER COMPOUNDS PNLIP, ELOVL1, ELOVL5 RNPEP 3086/4885METAP2 2666/4885METAP1 3714/4885
US-20050215623-A1 Palatability of aquaculture feed TAS2R3, TAS2R1, TAS2R20 RNPEP 1217/4885METAP2 3008/4885METAP1 2414/4885
US-20040175434-A1 Antimicrobial compositions MRPL21, FPR1, ARG1 RNPEP 2140/4885METAP2 3176/4885METAP1 1638/4885

“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.