SCHEMBL8413893

SCHEMBL8413893

CCCN1C(N2CCN(c3ccc(O)cc3)CC2)Cc2c(OC)cccc2S1(=O)=O

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TYR P14679 1/20 0.42
DRD2 P14416 5/20 0.39
HTR7 P34969 3/20 0.38
DRD4 P21917 2/20 0.38
KDM4E B2RXH2 1/20 0.37
LMNA P02545 1/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37

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
SCHEMBL8412349 0.91 L3MBTL1 (0.42) DRD2HTR7DRD4KDM4ELMNA
SCHEMBL8413371 0.81 TYR (0.41) TYRDRD2KDM4ELMNAGAA
SCHEMBL8412330 0.81 TYR (0.41) TYRDRD2HTR7KDM4ELMNA
SCHEMBL8413784 0.78 TYR (0.40) TYRDRD2HTR7KDM4ELMNA
SCHEMBL8412311 0.77 HSD11B1 (0.47) DRD2LMNA
SCHEMBL8413103 0.76 L3MBTL1 (0.41) DRD2HTR7DRD4KDM4ELMNA
SCHEMBL7109759 0.75 DRD2 (0.46) DRD2HTR7DRD4
SCHEMBL8412328 0.74 NPC1 (0.41) DRD2HTR7DRD4LMNAMAPT
SCHEMBL8413577 0.74 MAPT (0.40) TYRKDM4ELMNAGAAMAPT
SCHEMBL8410749 0.73 POLB (0.35) DRD2DRD4KDM4ELMNAMAPT

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-5874429-A ANTIISCHEMIC AGENTS; CEREBROVASCULAR DISORDERS; CIRCULATORY IDSORDERS SUNTORY LIMITED (JP) 1999-02-23 US disclosed