SCHEMBL6302532

SCHEMBL6302532

[CH2]CC(C(=O)O)(C(=O)O)C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.33
TSHR P16473 3/20 0.33
TP53 P04637 1/20 0.33
CYP2D6 P10635 1/20 0.30
CYP2C19 P33261 1/20 0.30
HIF1A Q16665 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
SCHEMBL5566654 0.69 ALDH1A1 (0.32) ALDH1A1TSHRTP53
SCHEMBL127725 0.67
SCHEMBL7717720 0.67 TSHR (0.42) ALDH1A1TSHRTP53CYP2D6CYP2C19
SCHEMBL724111 0.67 ALDH1A1 (0.35) ALDH1A1TSHRTP53CYP2D6CYP2C19
SCHEMBL2148666 0.65
SCHEMBL4646387 0.65
SCHEMBL23126 0.64 ALDH1A1 (0.53) ALDH1A1TSHRCYP2D6CYP2C19HIF1A
SCHEMBL115741 0.64 FFAR3 (0.41) ALDH1A1TSHRTP53CYP2D6CYP2C19
SCHEMBL241764 0.64 ALDH1A1 (0.33) ALDH1A1TSHRTP53CYP2D6CYP2C19
Water SCHEMBL5129171 0.62 FFAR3 (0.39) ALDH1A1TSHRTP53CYP2D6CYP2C19

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
EP-3533806-A1 GEL COMPOSITION AND METHOD FOR PRODUCING SAME Kewpie Corporation (JP) 2019-09-04 EP disclosed
US-20190264008-A1 Gel Composition and Method for Producing Same KEWPIE CORPORATION (JP) 2019-08-29 US disclosed
US-6875764-B1 Urea and thiourea compounds useful for treatment of coccidiosis NEW PHARMA RESEARCH SWEDEN AB (SE) 2005-04-05 US disclosed