SCHEMBL11675422

SCHEMBL11675422

C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.Cl[Ni]Cl

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.31
PKM P14618 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL10961446 1.00 GAA (0.31) GAAPKMTDP1
SCHEMBL20454582 0.97
SCHEMBL14675991 0.87 ALDH1A1 (0.33) GAAPKMTDP1
SCHEMBL9634079 0.87 ALDH1A1 (0.33) GAAPKMTDP1
SCHEMBL26953 0.87 ALDH1A1 (0.33) GAAPKMTDP1
SCHEMBL9633702 0.87 ALDH1A1 (0.33) GAAPKMTDP1
SCHEMBL3175920 0.87 ALDH1A1 (0.33) GAAPKMTDP1
SCHEMBL5511391 0.87 ALDH1A1 (0.33) GAAPKMTDP1
SCHEMBL22157999 0.87 ALDH1A1 (0.33) GAAPKMTDP1
SCHEMBL301767 0.87 ALDH1A1 (0.33) GAAPKMTDP1

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-4012399-A ULTRAVIOLET LIGHT ABSORBERS AND STABILIZERS CINCINNATI MILACRON CHEMICALS, INC. (US) 1977-03-15 US disclosed
US-3959220-A Polymer additives comprising transition metal complexes with trivalent phosphorous compounds CINCINNATI MILACRON CHEMICALS, INC. (US) 1976-05-25 US disclosed