SCHEMBL11041477

SCHEMBL11041477

CCOC(=O)C(Cl)C(C)(C)CCCl

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.36
ALDH1A1 P00352 4/20 0.34
CYP4F2 P78329 2/20 0.33
CYP4A11 Q02928 2/20 0.33
LMNA P02545 1/20 0.33
HSD17B10 Q99714 1/20 0.33
ALOX15 P16050 1/20 0.32
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32
SOAT1 P35610 1/20 0.32
MMP8 P22894 1/20 0.32
HCAR2 Q8TDS4 1/20 0.31
CPB2 Q96IY4 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
POLB P06746 1/20 0.31
HTT P42858 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL10782200 0.75
SCHEMBL11048262 0.75 LMNA (0.33) ALDH1A1LMNA
SCHEMBL6461960 0.69 CYP4F2 (0.58) ALDH1A1CYP4F2CYP4A11LMNAHSD17B10
SCHEMBL9715269 0.69 ALOX15 (0.41) SMN1; SMN2ALDH1A1LMNAHSD17B10ALOX15
SCHEMBL7971410 0.68 SMN1; SMN2 (0.41) SMN1; SMN2ALDH1A1LMNAHSD17B10ALOX15
SCHEMBL2170282 0.68
SCHEMBL6560711 0.67 ALDH1A1 (0.40) SMN1; SMN2ALDH1A1LMNAHSD17B10ALOX15
SCHEMBL5611272 0.67 MEN1 (0.57) SMN1; SMN2ALDH1A1CYP4F2CYP4A11LMNA
SCHEMBL7973321 0.67 SMN1; SMN2 (0.40) SMN1; SMN2ALDH1A1LMNAHSD17B10ALOX15
SCHEMBL6268325 0.67 CYP4F2 (0.65) SMN1; SMN2ALDH1A1CYP4F2CYP4A11LMNA

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-4440947-A Preparation of substituted alpha-halogeno-propionic acids and their derivatives BAYER AKTIENGESELLSCHAFT (DE) 1984-04-03 US disclosed
EP-0061629-A2 Process for the preparation of substituted alpha-halopropionic acids and of their derivatives; substituted vinylidene chloride BAYER AG (DE) 1982-10-06 EP disclosed