SCHEMBL6625925

SCHEMBL6625925

CC(Nc1ccc(N2CCSCC2)cc1)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.46
ALDH1A1 P00352 7/20 0.46
NPSR1 Q6W5P4 3/20 0.46
RECQL P46063 1/20 0.43
KMT2A Q03164 5/20 0.42
GAA P10253 3/20 0.42
MEN1 O00255 2/20 0.42
KDM4E B2RXH2 1/20 0.42
AKR1C3 P42330 1/20 0.41
GFER P55789 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C19 P33261 1/20 0.41
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
USP2 O75604 2/20 0.39
PKM P14618 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ESR1 P03372 1/20 0.39
NR4A1 P22736 1/20 0.39

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
SCHEMBL6625930 1.00 MAPT (0.46) MAPTALDH1A1NPSR1RECQLKMT2A
SCHEMBL6624638 0.84 ALDH1A1 (0.58) MAPTALDH1A1GAAKDM4ENPC1
SCHEMBL6624634 0.84 ALDH1A1 (0.58) MAPTALDH1A1GAAKDM4ENPC1
SCHEMBL27583633 0.82 MAPT (0.43) MAPTALDH1A1NPSR1RECQLKMT2A
SCHEMBL6626495 0.78 RORC (0.45) MAPTALDH1A1NPSR1RECQLKMT2A
SCHEMBL6626492 0.78 RORC (0.45) MAPTALDH1A1NPSR1RECQLKMT2A
SCHEMBL5221253 0.76 MAPT (0.51) MAPTALDH1A1NPSR1KMT2AGAA
SCHEMBL6625140 0.74 MAPT (0.56) MAPTALDH1A1KMT2AKDM4ERAB9A
SCHEMBL6628495 0.74 MAPT (0.56) MAPTALDH1A1KMT2AKDM4ERAB9A
SCHEMBL6625138 0.73 MAPT (0.42) MAPTALDH1A1NPSR1KMT2AGAA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040116417-A1 Thiohydantoins and use thereof for treating diabetes LABORATOIRES FOURNIER SA (FR) 2004-06-17 US disclosed
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