SCHEMBL8976776

SCHEMBL8976776

CC(CNCC(O)c1ccccc1)c1ccccc1

nearest known ligand 0.77

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.77
L3MBTL1 Q9Y468 1/20 0.77
ALDH1A1 P00352 2/20 0.55
AOC3 Q16853 4/20 0.55
TAAR1 Q96RJ0 1/20 0.55
KMT2A Q03164 1/20 0.54
LMNA P02545 2/20 0.51
BCAT2 O15382 1/20 0.49
ADRB2 P07550 1/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47

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
SCHEMBL9061582 1.00 KDM4E (0.77) KDM4EL3MBTL1ALDH1A1AOC3TAAR1
SCHEMBL11046082 0.88 TAAR1 (0.68) KDM4EL3MBTL1AOC3TAAR1KMT2A
SCHEMBL4408535 0.88 KDM4E (1.00) KDM4EL3MBTL1ALDH1A1AOC3KMT2A
SCHEMBL7532494 0.88 KDM4E (1.00) KDM4EL3MBTL1ALDH1A1AOC3KMT2A
SCHEMBL11459286 0.87 KDM4E (0.59) KDM4EL3MBTL1ALDH1A1TAAR1KMT2A
SCHEMBL12186411 0.86 KDM4E (0.80) KDM4EL3MBTL1ALDH1A1AOC3KMT2A
SCHEMBL7114926 0.86 KDM4E (0.80) KDM4EL3MBTL1ALDH1A1AOC3KMT2A
SCHEMBL9799340 0.85 ALDH1A1 (0.56) KDM4EL3MBTL1ALDH1A1TAAR1KMT2A
SCHEMBL11228161 0.83 KDM4E (0.74) KDM4EL3MBTL1ALDH1A1AOC3KMT2A
SCHEMBL15355176 0.83 KDM4E (0.74) KDM4EL3MBTL1ALDH1A1AOC3KMT2A

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-5508461-A ANTIOBESITY AGENTS DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1996-04-16 US disclosed