SCHEMBL3996997

SCHEMBL3996997

CCCC(=O)N=C1NCCS1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ INMT O95050 1/20 0.44
▸ FAAH O00519 1/20 0.31
▸ NAAA Q02083 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ RXFP1 Q9HBX9 1/20 0.31
▸ MEN1 O00255 1/20 0.30
▸ KMT2A Q03164 1/20 0.30

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
SCHEMBL12888282 0.69 — —
SCHEMBL7180702 0.66 KDM4E (0.51) INMT
SCHEMBL3656314 0.64 — —
SCHEMBL10969324 0.64 — —
SCHEMBL19541950 0.58 — —
SCHEMBL626129 0.57 CES2 (0.50) TSHRMEN1KMT2A
SCHEMBL6910110 0.57 INMT (0.42) INMT
SCHEMBL1796161 0.56 — —
SCHEMBL42694 0.56 — —
SCHEMBL6961963 0.55 CES1 (0.50) TSHRMEN1KMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2038278-A2 THIAZOLINE AND OXAZOLINE DERIVATIVES AND THEIR METHODS OF USE Abbott Laboratories (US) 2009-03-25 — — EP claimed
WO-2008002956-A2 THIAZOLINE AND OXAZOLINE DERIVATIVES AND THEIR METHODS OF USE ABBOTT LABORATORIES (US) 2008-01-03 — — WO claimed
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