SCHEMBL6624588

SCHEMBL6624588

CCOC(=O)Cc1cnc(NS(=O)(=O)c2ccc(Cl)cc2)s1

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.64
ALDH1A1 P00352 4/20 0.54
TSHR P16473 1/20 0.54
MEN1 O00255 6/20 0.50
PKM P14618 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
AKT1 P31749 1/20 0.48
IRS1 P35568 1/20 0.48
GAB1 Q13480 1/20 0.48
GAA P10253 1/20 0.48
POLB P06746 3/20 0.48
KLKB1 P03952 1/20 0.46
CTSB P07858 1/20 0.46
ELANE P08246 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.45

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
SCHEMBL6615532 0.89 ALDH1A1 (0.52) KMT2AALDH1A1TSHRMEN1PKM
SCHEMBL6623052 0.89 KMT2A (0.64) KMT2AALDH1A1TSHRMEN1PKM
SCHEMBL6624729 0.88 ALDH1A1 (0.51) KMT2AALDH1A1TSHRMEN1PKM
SCHEMBL6625259 0.87 ALDH1A1 (0.53) KMT2AALDH1A1TSHRMEN1CYP2C9
SCHEMBL6625890 0.86 KMT2A (0.66) KMT2AALDH1A1TSHRMEN1PKM
SCHEMBL6625513 0.84 POLB (0.51) KMT2AALDH1A1TSHRMEN1PKM
SCHEMBL3255724 0.83 LMNA (0.49) KMT2AALDH1A1MEN1SMN1; SMN2POLB
SCHEMBL6625022 0.83 ALDH1A1 (0.55) KMT2AALDH1A1TSHRMEN1CYP2C9
SCHEMBL6626147 0.83 HTT (0.59) KMT2AALDH1A1TSHRMEN1CYP2C9
SCHEMBL6628130 0.82 ALDH1A1 (0.51) KMT2AALDH1A1TSHRMEN1PKM

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
EP-1461325-A1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 BIOVITRUM AB (SE) 2004-09-29 EP disclosed
WO-2003043999-A1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 BIOVITRUM AB (SE) 2003-05-30 WO disclosed