SCHEMBL758273

SCHEMBL758273

C=CCNS(=O)(=O)c1cc(O)ccc1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.48
MAPK1 P28482 1/20 0.48
ALDH1A1 P00352 5/20 0.46
GAA P10253 3/20 0.46
KDM4E B2RXH2 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
CASP1 P29466 1/20 0.44
CASP7 P55210 1/20 0.44
MEP1B Q16820 1/20 0.42
SMN1; SMN2 Q16637 4/20 0.41
GFER P55789 1/20 0.41
PKM P14618 1/20 0.40
NPSR1 Q6W5P4 2/20 0.40
HTT P42858 1/20 0.40
CYTH2 Q99418 3/20 0.39
ATM Q13315 1/20 0.39
BRD4 O60885 1/20 0.39
BRD2 P25440 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
SCHEMBL1685394 0.81 BRD4 (0.51) TSHRALDH1A1GAAMEP1BSMN1; SMN2
SCHEMBL7834037 0.78 ALDH1A1 (0.48) TSHRALDH1A1GAAMEP1BSMN1; SMN2
SCHEMBL9005826 0.78 ALDH1A1 (0.54) TSHRMAPK1ALDH1A1GAAKDM4E
SCHEMBL4070788 0.78 TSHR (0.49) TSHRMAPK1ALDH1A1KDM4ECYP1A2
SCHEMBL10913560 0.77 GAA (0.56) TSHRMAPK1ALDH1A1GAASMN1; SMN2
SCHEMBL8469458 0.76 CA12 (0.50) TSHRALDH1A1GAACYP1A2MEP1B
SCHEMBL6231862 0.76 ALDH1A1 (0.46) TSHRALDH1A1GAAMEP1BSMN1; SMN2
SCHEMBL9853187 0.76 KDM4E (0.50) TSHRMAPK1ALDH1A1GAAKDM4E
SCHEMBL743630 0.75 LMNA (0.65) TSHRMAPK1ALDH1A1GAASMN1; SMN2
SCHEMBL1032718 0.75 KDM4E (0.60) TSHRALDH1A1GAAKDM4ECYP1A2

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
EP-2151331-B1 LOW-PERMEABILITY LAMINATE, AND PNEUMATIC TIRE UTILIZING THE SAME YOKOHAMA RUBBER CO LTD (JP) 2012-03-21 EP claimed