SCHEMBL11153237

SCHEMBL11153237

Cc1ccc(S(=O)(=O)OCC(COCc2ccccc2)OS(=O)(=O)c2ccc(C)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
LMNA P02545 5/20 0.42
GAA P10253 2/20 0.41
PKM P14618 1/20 0.41
AR P10275 1/20 0.41
CA9 Q16790 2/20 0.40
BCHE P06276 1/20 0.40
ACHE P22303 1/20 0.40
CA12 O43570 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
ATM Q13315 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MAPT P10636 2/20 0.39
CRHBP P24387 1/20 0.39
CRHR2 Q13324 1/20 0.39
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
CA4 P22748 1/20 0.39

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
SCHEMBL10761962 0.95 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2LMNAGAAPKM
SCHEMBL17789122 0.88 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2LMNAGAAPKM
SCHEMBL1105205 0.88 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2LMNAGAAPKM
SCHEMBL20489942 0.87 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2LMNAGAAPKM
SCHEMBL20489943 0.87 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2LMNAGAAPKM
SCHEMBL15120914 0.85 LMNA (0.44) ALDH1A1SMN1; SMN2LMNAGAAPKM
SCHEMBL15110982 0.85 LMNA (0.44) ALDH1A1SMN1; SMN2LMNAGAAPKM
SCHEMBL11184528 0.85 CA2 (0.44) ALDH1A1LMNAGAACA9BCHE
SCHEMBL2058187 0.85 GAA (0.42) ALDH1A1SMN1; SMN2GAAPKMCA9
SCHEMBL9575873 0.84 LMNA (0.40) ALDH1A1SMN1; SMN2LMNAGAAPKM

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-4393240-A BIS(DIPHENYPHOSPHINO) PROPANE DERIVATIVES FOR MAKING RHODIUM COMPLEX CATALYSTS STILLE JOHN K 1983-07-12 US claimed
US-4393240-A BIS(DIPHENYPHOSPHINO) PROPANE DERIVATIVES FOR MAKING RHODIUM COMPLEX CATALYSTS STILLE JOHN K 1983-07-12 US disclosed