SCHEMBL6624722

SCHEMBL6624722

CC1(c2ccc(N3CCOCC3)cc2)NC(=S)N(c2ccc(F)cc2)C1=O

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 5/20 0.47
DRD2 P14416 5/20 0.47
HTR7 P34969 5/20 0.47
MAPT P10636 6/20 0.47
ALDH1A1 P00352 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
KDM4E B2RXH2 1/20 0.47
AKR1C3 P42330 1/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
MGAT2 Q10469 1/20 0.40
MAPK1 P28482 1/20 0.39
GAA P10253 1/20 0.39
IDE P14735 1/20 0.39
HTT P42858 1/20 0.38
POLB P06746 1/20 0.38

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 0.89 CNR1 (0.46) HTR1ADRD2HTR7MAPTALDH1A1
SCHEMBL6628115 0.88 CNR1 (0.49) HTR1ADRD2HTR7MAPTALDH1A1
SCHEMBL6623977 0.88 MGAT2 (0.40) HTR1ADRD2HTR7MAPTALDH1A1
SCHEMBL6624454 0.88 HTT (0.42) HTR1ADRD2HTR7MAPTALDH1A1
SCHEMBL6625246 0.88 HTT (0.49) MAPTALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL6628598 0.88 MAPT (0.51) HTR1ADRD2HTR7MAPTALDH1A1
SCHEMBL6626671 0.88 RAD51 (0.47) HTR1ADRD2HTR7MAPTALDH1A1
SCHEMBL6628156 0.86 NPC1 (0.42) HTR1ADRD2HTR7MAPTALDH1A1
SCHEMBL6629939 0.86 MAPT (0.50) MAPTALDH1A1KDM4EAKR1C3MEN1
SCHEMBL6625449 0.85 MAPT (0.47) MAPTALDH1A1SMN1; SMN2KDM4EAKR1C3

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