SCHEMBL7530840

SCHEMBL7530840

O=C(Nc1ccc(Cl)cc1)c1cscc1NS(=O)(=O)c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.62
KMT2A Q03164 4/20 0.62
KDM4E B2RXH2 2/20 0.60
GPR27 Q9NS67 10/20 0.57
AVPR2 P30518 2/20 0.56
SLC10A2 Q12908 1/20 0.56
SLC10A1 Q14973 1/20 0.56
SLC10A6 Q3KNW5 1/20 0.56
GRM4 Q14833 3/20 0.53
ALDH1A1 P00352 1/20 0.52
LMNA P02545 1/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2D6 P10635 1/20 0.52
CYP2C9 P11712 1/20 0.52
HPGD P15428 1/20 0.52
CRHBP P24387 1/20 0.52
CYP2C19 P33261 1/20 0.52
HTT P42858 1/20 0.52
CRHR2 Q13324 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52

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
SCHEMBL7531883 0.88 MEN1 (0.60) MEN1KMT2AKDM4EGPR27AVPR2
SCHEMBL7534321 0.87 GPR27 (0.55) MEN1KMT2AKDM4EGPR27AVPR2
SCHEMBL7533583 0.82 MEN1 (0.50) MEN1KMT2AKDM4EGPR27AVPR2
SCHEMBL7532994 0.81 GPR27 (0.49) MEN1KMT2AKDM4EGPR27AVPR2
SCHEMBL7533441 0.81 GPR27 (0.49) MEN1KMT2AKDM4EGPR27GRM4
SCHEMBL7530848 0.80 GPR27 (0.52) MEN1KMT2AKDM4EGPR27AVPR2
SCHEMBL7531393 0.80 SLC10A2 (0.59) MEN1KMT2AKDM4EGPR27AVPR2
SCHEMBL7533491 0.79 KMT2A (0.48) MEN1KMT2AKDM4EALDH1A1HTT
SCHEMBL7533584 0.79 METAP2 (0.56) MEN1KMT2AKDM4EALDH1A1HTT
SCHEMBL7531362 0.78 KMT2A (0.62) MEN1KMT2AKDM4EGPR27AVPR2

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
WO-2002028353-A2 PHOSPHATE TRANSPORT INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2002-04-11 WO claimed
WO-2002028353-A2 PHOSPHATE TRANSPORT INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2002-04-11 WO disclosed