SCHEMBL10999953

SCHEMBL10999953

CCCCCCCC[Mg]C(C)CC

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.40
THRB P10828 1/20 0.40
TRPM8 Q7Z2W7 8/20 0.35
DNM1 Q05193 3/20 0.35
OPRM1 P35372 1/20 0.33
SPHK1 Q9NYA1 1/20 0.32
ALDH1A1 P00352 2/20 0.32
LMNA P02545 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL6564484 1.00 TSHR (0.40) TSHRTHRBTRPM8DNM1OPRM1
SCHEMBL5561432 0.91 TRPM8 (0.33) TSHRTHRBTRPM8DNM1
SCHEMBL11230622 0.91 TRPM8 (0.33) TSHRTHRBTRPM8DNM1
SCHEMBL164254 0.90
SCHEMBL9577626 0.87 TSHR (0.32) TSHRTRPM8LMNA
SCHEMBL11532056 0.81 LMNA (0.39) LMNA
SCHEMBL11189521 0.81
SCHEMBL10757392 0.79
SCHEMBL11616978 0.79 TSHR (0.44) TSHRTHRBTRPM8DNM1OPRM1
SCHEMBL8511451 0.79 TSHR (0.44) TSHRTHRBTRPM8DNM1OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4547475-A LOW TEMPERATURE REACTION OF MAGNESIUM COMPOUND AND NON-METALLIC HALIDE THE DOW CHEMICAL COMPANY (US) 1985-10-15 US claimed