SCHEMBL6625449

SCHEMBL6625449

CC1(c2ccc(N3CCOCC3)cc2)NC(=S)N(c2ccc([N+](=O)[O-])cc2)C1=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.47
KDM4E B2RXH2 2/20 0.47
GAA P10253 1/20 0.47
BLM P54132 1/20 0.47
AKR1C3 P42330 1/20 0.46
ALDH1A1 P00352 2/20 0.44
POLB P06746 2/20 0.44
CRBN Q96SW2 1/20 0.44
SIRT6 Q8N6T7 2/20 0.43
ADRB1 P08588 1/20 0.43
CYP1A2 P05177 1/20 0.42
CYP2C9 P11712 1/20 0.42
HPGD P15428 1/20 0.42
KMT2A Q03164 3/20 0.42
TDP1 Q9NUW8 3/20 0.42
IDE P14735 1/20 0.41
MEN1 O00255 2/20 0.41
MAPK1 P28482 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PKM P14618 1/20 0.41

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
SCHEMBL6625012 0.86 CNR1 (0.46) MAPTGAAALDH1A1HPGDKMT2A
SCHEMBL6623977 0.85 MGAT2 (0.40) MAPTKDM4EGAAALDH1A1CRBN
SCHEMBL6628115 0.85 CNR1 (0.49) MAPTKDM4EAKR1C3ALDH1A1HPGD
SCHEMBL6624454 0.85 HTT (0.42) MAPTKDM4EGAAALDH1A1POLB
SCHEMBL6624722 0.85 HTR1A (0.47) MAPTKDM4EGAAAKR1C3ALDH1A1
SCHEMBL6625246 0.85 HTT (0.49) MAPTGAAALDH1A1KMT2ATDP1
SCHEMBL6628156 0.83 NPC1 (0.42) MAPTKDM4EGAAALDH1A1HPGD
SCHEMBL6629939 0.83 MAPT (0.50) MAPTKDM4EGAAAKR1C3ALDH1A1
SCHEMBL6626698 0.81 KMT2A (0.43) MAPTKDM4EGAAALDH1A1POLB
SCHEMBL6626057 0.81 MAPT (0.48) MAPTKDM4EGAAALDH1A1POLB

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-1373219-A1 THIOHYDANTOINS AND USE THEREOF FOR TREATING DIABETES LABORATOIRES FOURNIER S.A. (FR) 2004-01-02 EP disclosed
WO-2002081453-A1 THIOHYDANTOINS AND USE THEREOF FOR TREATING DIABETES LABORATOIRES FOURNIER SA (FR) 2002-10-17 WO disclosed