SCHEMBL9508557

SCHEMBL9508557

CCC(C)(CC)CC(=COC(=O)CC(C)=O)C(=O)O

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.34
GAA P10253 1/20 0.34
SI P14410 1/20 0.34
MGAM2 Q2M2H8 1/20 0.34

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
SCHEMBL370148 0.80 MGAM (0.41) MGAMGAASIMGAM2
SCHEMBL4402044 0.77 MGAM (0.39) MGAMGAASIMGAM2
SCHEMBL9243472 0.74 APEX1 (0.38) MGAMGAASIMGAM2
SCHEMBL8983190 0.72 MGAM (0.38) MGAMGAASIMGAM2
SCHEMBL727176 0.70 MGAM (0.46) MGAMGAASIMGAM2
SCHEMBL27281470 0.67 MGAM (0.52) MGAMGAASIMGAM2
SCHEMBL28138867 0.67 MGAM (0.39) MGAMGAASIMGAM2
SCHEMBL17933420 0.64 ALDH1A1 (0.42)
SCHEMBL27403155 0.64 MGAM (0.48) MGAMGAASIMGAM2
SCHEMBL28073484 0.64 MGAM (0.48) MGAMGAASIMGAM2

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
EP-0241127-B1 TEXTILE MATERIALS, METHODS OF MANUFACTURE AND COMPOSITIONS FOR USE THEREIN ROHM AND HAAS COMPANY (US) 1993-10-13 EP disclosed
US-4966791-A BONDING FIBERS WITH POLYMER CONTAINING POLYMERIZED UNSATURATED CARBOXYLIC ESTER MONOMERS AND PENDANT GROUPS WITH TWO CARBONYL OR CARBONYL AND CYANO GROUPS UNION OIL COMPANY OF CALIFORNIA (US) 1990-10-30 US disclosed
US-4900615-A Textile materials and compositions for use therein UNION OIL COMPANY OF CALIFORNIA (US) 1990-02-13 US disclosed
EP-0241127-A2 Textile materials, methods of manufacture and compositions for use therein ROHM AND HAAS COMPANY (US) 1987-10-14 EP disclosed