SCHEMBL16705175

SCHEMBL16705175

CNC(=O)Nc1ccc(S(=O)(=O)O)c(S(=O)(=O)O)c1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 1/20 0.54
KMT2A Q03164 1/20 0.51
ALDH1A1 P00352 4/20 0.49
PRMT1 Q99873 1/20 0.45
KDM4E B2RXH2 1/20 0.44
HPGD P15428 1/20 0.44
PIP4K2A P48426 1/20 0.43
PIP4K2B P78356 1/20 0.43
POLB P06746 2/20 0.43
CASR P41180 1/20 0.43
IDH1 O75874 3/20 0.42
KCNJ6 P48051 3/20 0.41
KCNJ5 P48544 3/20 0.41
KCNJ3 P48549 3/20 0.41
MAPT P10636 1/20 0.41
GRIK1 P39086 1/20 0.41
GRIK2 Q13002 1/20 0.41
RECQL P46063 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL21033369 0.78 TIMP3 (0.68) ENPP2KMT2AALDH1A1PRMT1KDM4E
SCHEMBL16705173 0.77 KMT2A (0.71) KMT2AALDH1A1POLB
SCHEMBL11715620 0.77 TNNI3 (0.40) ENPP2KMT2AALDH1A1PRMT1KDM4E
SCHEMBL3917549 0.76 ALDH1A1 (0.53) KMT2AALDH1A1POLBIDH1KCNJ6
SCHEMBL12049676 0.76 ALDH1A1 (0.49) KMT2AALDH1A1KDM4EHPGDPIP4K2A
SCHEMBL15116963 0.74 ENPP2 (0.62) ENPP2KMT2AALDH1A1HPGDPOLB
SCHEMBL10155599 0.74 ALDH1A1 (0.78) KMT2AALDH1A1KDM4EHPGDPIP4K2A
SCHEMBL14289782 0.74 KMT2A (0.58) KMT2AALDH1A1KDM4EHPGDIDH1
SCHEMBL10487505 0.74 ENPP2 (0.55) ENPP2KMT2AALDH1A1PRMT1CASR
SCHEMBL10893023 0.74 EPHX1 (0.61) ENPP2KMT2AALDH1A1IDH1KCNJ6

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-9029492-B2 Superconducting electrolytic hybrid material, and preparation method and uses thereof CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2015-05-12 US disclosed