SCHEMBL9626734

SCHEMBL9626734

CC(CCSc1ccccc1)O[C@H]1CCCCO1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.39
HSD17B10 Q99714 2/20 0.39
ALDH1A1 P00352 3/20 0.37
KDM4C Q9H3R0 1/20 0.36
TSHR P16473 2/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
MAPK1 P28482 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
KDM4E B2RXH2 1/20 0.34
SLC6A3 Q01959 2/20 0.34
MAPT P10636 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
PDE8B O95263 1/20 0.32

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
SCHEMBL27032120 0.79 KDM4C (0.38) KDM4CTSHRMEN1KMT2ASLC6A3
SCHEMBL27133765 0.79 KDM4C (0.38) KDM4CTSHRMEN1KMT2ASLC6A3
SCHEMBL7050550 0.78 SIGMAR1 (0.39) HPGDKDM4CMAOAMEN1KMT2A
SCHEMBL9628663 0.75 KMT2A (0.39) ALDH1A1MEN1KMT2ASLC6A3MAPT
SCHEMBL27032027 0.75 KDM4C (0.35) HPGDKDM4CMEN1KMT2AL3MBTL1
SCHEMBL27131274 0.75 KDM4C (0.35) HPGDKDM4CMEN1KMT2AL3MBTL1
Bromide SCHEMBL23387051 0.74 CHRNA7 (0.36) KDM4CMEN1KMT2ASLC6A3
SCHEMBL27032595 0.74 KDM4C (0.35) HPGDKDM4CMEN1KMT2ASLC6A3
SCHEMBL27032302 0.74 KDM4C (0.35) HPGDKDM4CMEN1KMT2ASLC6A3
SCHEMBL27131754 0.74 KDM4C (0.35) HPGDKDM4CMEN1KMT2ASLC6A3

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-5081152-A AZULENE DERIVATIVES AS THROMBOXANE A2 AND PROSTAGLANDIN ENDOPEROXIDE RECEPTOR ANTAGONIST KOTOBUKI SEIYAKU CO., LTD. (JP) 1992-01-14 US disclosed