SCHEMBL9427116

SCHEMBL9427116

Cc1ccc(-c2cc3ccc(NS(=O)(=O)c4ccccc4)cc3oc2=O)c(C(=O)O)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ METAP2 P50579 2/20 0.51
▸ GPR27 Q9NS67 2/20 0.47
▸ KDM4E B2RXH2 4/20 0.47
▸ ALDH1A1 P00352 4/20 0.47
▸ GLA P06280 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ PKM P14618 1/20 0.47
▸ LMNA P02545 2/20 0.46
▸ PTPN2 P17706 3/20 0.45
▸ PTPN1 P18031 3/20 0.45
▸ PTPN5 P54829 3/20 0.45
▸ PTPRC P08575 1/20 0.45
▸ MEN1 O00255 3/20 0.44
▸ KMT2A Q03164 3/20 0.44
▸ AVPR2 P30518 1/20 0.43
▸ MCL1 Q07820 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ POLB P06746 1/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ CYP2D6 P10635 1/20 0.42

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
SCHEMBL11370585 0.81 PTPN1 (0.62) KDM4EALDH1A1GAALMNAPTPN2
SCHEMBL11231219 0.77 KDM4E (0.66) KDM4EALDH1A1GLAGAAPKM
SCHEMBL17701088 0.74 PTPN2 (0.54) GPR27ALDH1A1PTPN2PTPN1PTPN5
SCHEMBL24270367 0.74 MAPT (0.52) GPR27KDM4EALDH1A1GLAGAA
SCHEMBL9426829 0.71 TOP2A (0.58) ALDH1A1LMNAPTPN2PTPN1PTPN5
SCHEMBL11006648 0.71 PIK3CD (0.62) KDM4EALDH1A1PTPN2PTPN1PTPN5
SCHEMBL2009251 0.69 METAP2 (1.00) METAP2ALDH1A1GAALMNAMCL1
SCHEMBL13769008 0.68 MAOB (0.65) ALDH1A1
SCHEMBL10305750 0.67 CA12 (0.77) KDM4EALDH1A1GLAGAAMEN1
SCHEMBL28607455 0.67 PKM (0.67) KDM4EALDH1A1GLAGAAPKM

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-5300656-A Immunoassay BAYER AKTIENGESELLSCHAFT (DE) 1994-04-05 — — US disclosed
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