SCHEMBL14536744

SCHEMBL14536744

Cc1cc(C(=O)O)sc1S(=O)(=O)NCC1CC1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.46
MEN1 O00255 5/20 0.46
ALDH1A1 P00352 3/20 0.46
CYP2C9 P11712 1/20 0.46
GBA1 P04062 1/20 0.43
CNR1 P21554 1/20 0.42
CNR2 P34972 1/20 0.42
NPY5R Q15761 5/20 0.42
MAPT P10636 3/20 0.41
DAO P14920 2/20 0.41
KDM4E B2RXH2 1/20 0.41
TP53 P04637 1/20 0.41
LMNA P02545 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL4607774 0.90 MCL1 (0.46) KMT2AMEN1ALDH1A1CYP2C9CNR1
SCHEMBL14507412 0.76 DAO (0.41) KMT2AMEN1ALDH1A1CNR2NPY5R
SCHEMBL28225381 0.73 DAO (0.56) KMT2AMEN1ALDH1A1MAPTDAO
SCHEMBL14507360 0.71 DAO (0.57) KMT2AMEN1ALDH1A1MAPTDAO
SCHEMBL14507372 0.68 MAPT (0.43) KMT2AMEN1ALDH1A1CYP2C9GBA1
SCHEMBL14507410 0.68 MCL1 (0.40) KMT2AMEN1ALDH1A1CNR2MAPT
SCHEMBL15881071 0.65 MCL1 (0.53) KMT2AMEN1ALDH1A1MAPTDAO
SCHEMBL4395470 0.64 LMNA (0.40) KMT2AMEN1ALDH1A1CYP2C9MAPT
SCHEMBL4395465 0.64 LMNA (0.40) KMT2AMEN1ALDH1A1CYP2C9MAPT
SCHEMBL3686019 0.64 NPSR1 (0.58)

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
WO-2007056468-A1 METHODS FOR INHIBITING PROTEIN KINASES SCHERING CORPORATION (US) 2007-05-18 WO disclosed