SCHEMBL6704097

SCHEMBL6704097

CC1C(=O)N(c2ccccc2)C(=S)N1c1ccc(N2CCOCC2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 3/20 0.53
MAPT P10636 6/20 0.52
ALDH1A1 P00352 6/20 0.52
GAA P10253 3/20 0.52
ALOX12 P18054 2/20 0.52
LMNA P02545 1/20 0.47
HCRTR1 O43613 1/20 0.46
KMT2A Q03164 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
MEN1 O00255 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.44
RAD51 Q06609 1/20 0.44
PARP1 P09874 1/20 0.43
PKM P14618 1/20 0.43
TSHR P16473 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
AKR1C3 P42330 1/20 0.43
KDM4E B2RXH2 1/20 0.41
POLB P06746 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
SCHEMBL6702824 1.00 KIF11 (0.53) KIF11MAPTALDH1A1GAAALOX12
SCHEMBL6702073 0.89 RAD51 (0.49) KIF11MAPTALDH1A1GAAALOX12
SCHEMBL6699022 0.89 KIF11 (0.54) KIF11MAPTALDH1A1GAAALOX12
SCHEMBL6703556 0.89 MAPT (0.46) KIF11MAPTALDH1A1GAAALOX12
SCHEMBL6703729 0.89 PARP1 (0.42) KIF11MAPTALDH1A1GAAALOX12
SCHEMBL6703155 0.87 ALDH1A1 (0.52) KIF11MAPTALDH1A1GAAALOX12
SCHEMBL6704444 0.87 ALDH1A1 (0.51) KIF11MAPTALDH1A1GAAALOX12
SCHEMBL6705448 0.86 ALDH1A1 (0.42) KIF11MAPTALDH1A1GAAALOX12
SCHEMBL6703990 0.86 ALDH1A1 (0.51) MAPTALDH1A1GAAALOX12LMNA
SCHEMBL6704844 0.86 MAPT (0.51) KIF11MAPTALDH1A1GAAALOX12

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