SCHEMBL8903406

SCHEMBL8903406

CN(C)CCN1CCN(n2c(=O)sc3ccc(Br)c(C=C=O)c32)CC1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 1/20 0.32
▸ P2RX7 Q99572 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
SCHEMBL8902723 0.91 — —
SCHEMBL8902541 0.87 SIGMAR1 (0.31) —
SCHEMBL8902250 0.82 ACHE (0.34) ACHEP2RX7
SCHEMBL10974771 0.75 HSD17B10 (0.34) —
SCHEMBL11442654 0.73 NSD2 (0.31) —
SCHEMBL8903400 0.60 SIGMAR1 (0.40) ACHEP2RX7
SCHEMBL8903391 0.59 GAA (0.53) —
SCHEMBL11981684 0.58 HRH4 (0.50) ACHEP2RX7
SCHEMBL2231151 0.57 PIM1 (0.42) —
SCHEMBL1186740 0.57 — —

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
WO-1997043282-A2 BENZOTHIAZOLINONES AS ANTI-ASTHMATIC AGENTS KLINGE PHARMA GMBH (DE) 1997-11-20 — — WO disclosed
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