SCHEMBL4371383

SCHEMBL4371383

COC(=O)c1ncsc1-c1ccc(Cl)cc1Cl

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALPL P05186 1/20 0.49
S1PR4 O95977 1/20 0.45
SLC6A3 Q01959 1/20 0.45
MAPT P10636 5/20 0.43
POLB P06746 2/20 0.42
KDM4E B2RXH2 3/20 0.41
ALDH1A1 P00352 3/20 0.41
PKM P14618 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CNR1 P21554 2/20 0.41
MRGPRX4 Q96LA9 2/20 0.41
GRM1 Q13255 1/20 0.40
GRM4 Q14833 1/20 0.40
RAB9A P51151 3/20 0.40
NPC1 O15118 2/20 0.40
HPGD P15428 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40

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
SCHEMBL9587799 0.86 MAPT (0.53) MAPTPOLBKDM4ESMN1; SMN2RAB9A
SCHEMBL4380087 0.83 KDM4E (0.51) ALPLMAPTKDM4EALDH1A1SMN1; SMN2
SCHEMBL4371693 0.78 ALPL (0.49) ALPLSLC6A3MAPTPOLBKDM4E
SCHEMBL983944 0.78 SLC6A3 (0.47) SLC6A3KDM4ECYP1A2CYP3A4
SCHEMBL4380144 0.76 KDM4E (0.68) ALPLS1PR4SLC6A3MAPTPOLB
SCHEMBL9587747 0.76 CNR1 (0.43) ALPLMAPTPOLBL3MBTL1CNR1
SCHEMBL9588826 0.75 MAPT (0.45) MAPTPOLBKDM4EALDH1A1SMN1; SMN2
SCHEMBL10432896 0.74 SMN1; SMN2 (0.39) ALPLMAPTPOLBKDM4EALDH1A1
SCHEMBL23538248 0.72 NPSR1 (0.46) S1PR4MAPTPOLBKDM4EALDH1A1
SCHEMBL24984506 0.72 ALPL (0.58) ALPLS1PR4SLC6A3MAPTPOLB

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-2009117421-A2 HETEROCYCLIC MODULATORS OF GPR119 FOR TREATMENT OF DISEASE KALYPSYS, INC. (US) 2009-09-24 WO disclosed
WO-2009117421-A2 HETEROCYCLIC MODULATORS OF GPR119 FOR TREATMENT OF DISEASE KALYPSYS, INC. (US) 2009-09-24 WO disclosed