SCHEMBL8690975

SCHEMBL8690975

NS(=O)(=O)c1ccc(NC(=O)c2cc(-c3ccccc3)[nH]n2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.57
MEN1 O00255 5/20 0.57
MAPT P10636 3/20 0.57
POLB P06746 3/20 0.57
PSMD14 O00487 2/20 0.57
CACNA1B Q00975 2/20 0.57
APBA1 Q02410 2/20 0.57
RECQL P46063 1/20 0.57
CTDSP1 Q9GZU7 1/20 0.57
SAE1 Q9UBE0 1/20 0.57
UBA2 Q9UBT2 1/20 0.57
CA1 P00915 7/20 0.56
CA2 P00918 7/20 0.56
CA9 Q16790 5/20 0.56
CA12 O43570 4/20 0.56
CDK2 P24941 4/20 0.54
CDK1 P06493 2/20 0.51
FGB P02675 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51

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
SCHEMBL8640966 0.89 KMT2A (0.56) KMT2AMEN1MAPTPOLBCA1
SCHEMBL8691553 0.88 PTPN7 (0.54) KMT2AMEN1MAPTCA1CA2
SCHEMBL8642022 0.88 CDK2 (0.64) KMT2AMEN1MAPTPOLBPSMD14
SCHEMBL8694108 0.88 CDK2 (0.64) KMT2AMEN1MAPTCA1CA2
SCHEMBL15503777 0.86 KMT2A (0.67) KMT2AMEN1MAPTPOLBPSMD14
SCHEMBL8688441 0.85 CDK2 (0.47) KMT2AMEN1MAPTPOLBPSMD14
SCHEMBL8691753 0.85 CDK2 (0.66) MAPTPOLBCA1CA2CA9
SCHEMBL8688552 0.85 CDK2 (0.52) KMT2ACA1CA2CA9CA12
SCHEMBL8732480 0.81 KMT2A (0.47) KMT2AMEN1MAPTPOLBCA1
SCHEMBL17593242 0.80 PHGDH (0.70) KMT2AMEN1POLB

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-5760068-A NONSTEROIDAL ANTIINFLAMMATORY AGENTS WITH REDUCED SIDE EFFECTS G.D. SEARLE & CO. (US) 1998-06-02 US disclosed
US-5756529-A ANTIINFLAMMATORY G.D. SEARLE & CO. (US) 1998-05-26 US disclosed