SCHEMBL8006243

SCHEMBL8006243

ClCOc1ccc(-c2cc[c]cc2)cc1OCCl

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
POLB P06746 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
MAPK1 P28482 1/20 0.32
KMT2A Q03164 1/20 0.32
HSD17B10 Q99714 1/20 0.32
L3MBTL1 Q9Y468 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
SCHEMBL7462172 0.81 KDM4E (0.42) KDM4EMEN1ALDH1A1MAPTHPGD
SCHEMBL9020733 0.77 HPGD (0.41) KDM4EMEN1ALDH1A1POLBMAPT
SCHEMBL10500440 0.76 CYP3A4 (0.33) ALDH1A1HPGDHSD17B10
SCHEMBL322590 0.71 PDE4A (0.52) KDM4EMEN1ALDH1A1MAPTHPGD
SCHEMBL28467263 0.71 PDE4A (0.52) KDM4EMEN1ALDH1A1MAPTHPGD
SCHEMBL9476831 0.67 KDM1A (0.44) KDM4EMEN1ALDH1A1POLBMAPT
SCHEMBL17200849 0.67 ALDH1A1 (0.35) ALDH1A1
SCHEMBL208526 0.67 ALDH1A1 (0.35) ALDH1A1
SCHEMBL5538521 0.67 EPHX2 (0.36)
SCHEMBL1007150 0.66

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-6110947-A AN ANALGESIC AGENT FOR TREATING STROKE, ABDOMINAL PAIN; AS ANTIINFLAMMATORY, DIURETIC, ANESTHETIC OR NEUROPROTECTIVE AGENTS PFIZER INC. (US) 2000-08-29 US disclosed