SCHEMBL11737367

SCHEMBL11737367

c1csc(C(N=C2CCCCCN2)C2CC2)c1

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.31
PSEN1 P49768 1/20 0.30
PSEN2 P49810 1/20 0.30
APH1B Q8WW43 1/20 0.30
NCSTN Q92542 1/20 0.30
APH1A Q96BI3 1/20 0.30
PSENEN Q9NZ42 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
SCHEMBL11738911 0.95 MAPT (0.31) MAPTPSEN1PSEN2APH1BNCSTN
SCHEMBL11738912 0.95 MAPT (0.31) MAPTPSEN1PSEN2APH1BNCSTN
SCHEMBL7327523 0.79 PSEN1 (0.30) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL7327942 0.76 MAPT (0.33) MAPT
SCHEMBL7356723 0.76 MAPT (0.33) MAPT
SCHEMBL7327933 0.76 MAPT (0.33) MAPT
SCHEMBL7326534 0.76 SLC6A3 (0.35)
SCHEMBL7326538 0.76 SLC6A3 (0.35)
SCHEMBL7333402 0.74 IDO1 (0.39)
SCHEMBL7333528 0.74 IDO1 (0.36)

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-4061746-A Lactamimide inhibitors of gastrointestinal hypersecretion RICHARDSON-MERRELL INC. (US) 1977-12-06 US disclosed