SCHEMBL23934875

SCHEMBL23934875

CC(=O)C(=O)OCC1CC(=O)O1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.35
NLRP3 Q96P20 2/20 0.32
PRKCA P17252 6/20 0.31
CYP3A4 P08684 2/20 0.31
CYP2D6 P10635 1/20 0.31
TSHR P16473 1/20 0.31
CYP2C19 P33261 1/20 0.31
TP53 P04637 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
SCHEMBL12903287 0.86 ALDH1A1 (0.64) ALDH1A1SMN1; SMN2NLRP3CYP3A4CYP2D6
SCHEMBL20617446 0.85 NLRP3 (0.44) ALDH1A1SMN1; SMN2NLRP3PRKCA
SCHEMBL15274803 0.84 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2CYP3A4CYP2D6TSHR
SCHEMBL15274793 0.80 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2PRKCACYP3A4CYP2D6
SCHEMBL16018493 0.77 ALDH1A1 (0.45) ALDH1A1CYP3A4CYP2D6TSHRCYP2C19
SCHEMBL15274795 0.77 ALDH1A1 (0.34) ALDH1A1SMN1; SMN2TSHR
SCHEMBL15274796 0.77 ALDH1A1 (0.41) ALDH1A1NLRP3PRKCA
SCHEMBL20624908 0.77 ALOX15 (0.33) ALDH1A1SMN1; SMN2CYP3A4TP53
SCHEMBL7641668 0.76 ALDH1A1 (0.71) ALDH1A1CYP3A4TSHRTP53
SCHEMBL15274812 0.76 ALDH1A1 (0.40) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11814498-B2 Polylactone foams and methods of making the same NOVOMER, INC. (US) 2023-11-14 US disclosed
US-11814498-B2 Polylactone foams and methods of making the same NOVOMER, INC. (US) 2023-11-14 US disclosed
US-20210324168-A1 POLYLACTONE FOAMS AND METHODS OF MAKING THE SAME NOVOMER, INC. 2021-10-21 US disclosed