SCHEMBL10548265

SCHEMBL10548265

CCCCCCN(C(=O)c1ccc(C(C)=O)o1)C(C)C

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ THRA P10827 4/20 0.41
▸ THRB P10828 4/20 0.41
▸ EPHX2 P34913 1/20 0.39
▸ PDE6D O43924 1/20 0.38
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ CNR2 P34972 3/20 0.36
▸ MAOA P21397 1/20 0.36
▸ MAOB P27338 1/20 0.36
▸ SERPINE1 P05121 1/20 0.35
▸ HPGD P15428 1/20 0.35

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
SCHEMBL10549257 0.85 THRA (0.41) THRATHRBEPHX2PDE6DMEN1
SCHEMBL10544258 0.81 ALDH1A1 (0.47) THRATHRBMEN1KMT2ATDP1
SCHEMBL12512504 0.71 EPHX2 (0.50) EPHX2MEN1KMT2A
SCHEMBL10548133 0.71 PSEN1 (0.53) MEN1KMT2ATDP1
SCHEMBL16297556 0.69 EPHX2 (0.47) EPHX2MEN1KMT2A
SCHEMBL10547612 0.69 KMT2A (0.43) MEN1KMT2AMAOB
SCHEMBL10422627 0.68 EPHX2 (0.52) THRATHRBEPHX2MEN1KMT2A
SCHEMBL8365120 0.68 EPHX2 (0.52) THRATHRBEPHX2MEN1KMT2A
SCHEMBL10423263 0.68 EPHX2 (0.52) THRATHRBEPHX2MEN1KMT2A
SCHEMBL1759008 0.68 EPHX2 (0.54) EPHX2MEN1KMT2ATDP1

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-4814341-A HISTAMINE H2 ANTAGONISTS REITER LAWRENCE A (US) 1989-03-21 — — US disclosed
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