SCHEMBL7366315

SCHEMBL7366315

O=C[C@@H]1CSCN1C(=O)CCC(=O)CCc1ccc2ccccc2c1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 1/20 0.40
CYP1A2 P05177 1/20 0.40
HCAR2 Q8TDS4 1/20 0.39
NAAA Q02083 1/20 0.38
HDAC1 Q13547 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
DPP4 P27487 1/20 0.36
FFAR1 O14842 1/20 0.35
BCHE P06276 1/20 0.35
HTR2C P28335 1/20 0.35
ADRA1A P35348 1/20 0.35
HTR2B P41595 1/20 0.35
HTR6 P50406 1/20 0.35
SLC6A3 Q01959 1/20 0.35
PREP P48147 1/20 0.35
HRH3 Q9Y5N1 1/20 0.34
CXCR4 P61073 1/20 0.34
SIGMAR1 Q99720 2/20 0.34

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
SCHEMBL7320636 0.83 TPSAB1 (0.40) HDAC1HDAC8CXCR4SIGMAR1
SCHEMBL7375088 0.82 TDP1 (0.40) NAAAFFAR1BCHE
SCHEMBL7279739 0.81 UTS2R (0.43) PDPK1CYP1A2HCAR2NAAAHRH3
SCHEMBL7318507 0.81 NPC1 (0.40) SLC6A3CXCR4SIGMAR1
SCHEMBL7370031 0.80 GRM2 (0.36) HDAC1HDAC8DPP4BCHE
SCHEMBL7366403 0.74 NPC1 (0.48) NAAAHDAC1HDAC8BCHEADRA1A
SCHEMBL7332873 0.74 CYP1A2 (0.66) PDPK1CYP1A2HCAR2HDAC1HDAC8
SCHEMBL7370146 0.73 PREP (0.48) HDAC1HDAC8ADRA1APREPSIGMAR1
SCHEMBL7374067 0.72 HPGD (0.39)
SCHEMBL7370574 0.72 MAPT (0.47) NAAAHDAC1PREP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0461677-B1 Novel thiazolidine derivatives ONO PHARMACEUTICAL CO (JP) 1997-04-16 EP claimed
EP-0461677-A1 Novel thiazolidine derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1991-12-18 EP claimed
US-4857537-A PREVENTING AMNESIA ONO PHARMACEUTICAL CO., LTD. (JP) 1989-08-15 US claimed
EP-0280956-A1 Thiazolidine derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1988-09-07 EP claimed
US-4857537-A PREVENTING AMNESIA ONO PHARMACEUTICAL CO., LTD. (JP) 1989-08-15 US disclosed