SCHEMBL9065489

SCHEMBL9065489

CCC(CC)(CCl)OC(=O)CC(=O)OC(CC)(CC)CCl

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.37
GAA P10253 1/20 0.37
SI P14410 1/20 0.37
MGAM2 Q2M2H8 1/20 0.37

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
SCHEMBL9065496 0.90 LDHA (0.31)
SCHEMBL2967813 0.85 GAA (0.43) MGAMGAASIMGAM2
SCHEMBL9065889 0.79 FAAH (0.36) MGAMGAASIMGAM2
SCHEMBL2957094 0.77 MGAM (0.37) MGAMGAASIMGAM2
SCHEMBL2967817 0.74 LDHA (0.36) MGAMGAASIMGAM2
SCHEMBL11703203 0.72 EPHX1 (0.38)
SCHEMBL646828 0.70 TSHR (0.41) MGAMGAASIMGAM2
SCHEMBL21847353 0.70 ALDH1A1 (0.38) MGAMGAASIMGAM2
SCHEMBL4145066 0.69 MGAM (0.42) MGAMGAASIMGAM2
SCHEMBL9820088 0.69 GAA (0.42) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5569780-A Dialkyl 2-haloethyl malonates HULS AKTIENGESELLSCHAFT (DE) 1996-10-29 US disclosed
US-5463111-A Process for preparing dialkyl 2-haloethyl malonates HULS AKTIENGESELLSCHAFT (DE) 1995-10-31 US disclosed