SCHEMBL16664003

SCHEMBL16664003

CC1(C)Cc2sc(-c3cccc(Br)c3)cc2C2(CCSC(N)=N2)C1

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 0.46
CTSD P07339 3/20 0.46
KCNH2 Q12809 1/20 0.36
APP P05067 1/20 0.33
BACE2 Q9Y5Z0 1/20 0.31

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
SCHEMBL17655622 0.86 BACE1 (0.46) BACE1CTSDKCNH2
SCHEMBL15606015 0.85 BACE1 (0.53) BACE1CTSDKCNH2
SCHEMBL15606016 0.84 BACE1 (0.47) BACE1CTSDKCNH2
SCHEMBL15606179 0.77 BACE1 (0.49) BACE1CTSDKCNH2BACE2
SCHEMBL15605989 0.77 BACE1 (0.35) BACE1KCNH2
SCHEMBL17655623 0.77 BACE1 (0.35) BACE1KCNH2
SCHEMBL16663951 0.76 BACE1 (0.47) BACE1CTSDKCNH2BACE2
SCHEMBL429328 0.76 BACE1 (0.62) BACE1CTSDAPP
SCHEMBL15606038 0.71 BACE1 (0.36) BACE1CTSDKCNH2BACE2
SCHEMBL15606014 0.71 BACE1 (0.34) BACE1CTSDKCNH2BACE2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9233982-B2 Spiro tetrahydro—benzothiophen derivatives useful for the treatment neurodegenerative diseases ARES TRADING S.A. (CH) 2016-01-12 US disclosed
US-9233982-B2 Spiro tetrahydro—benzothiophen derivatives useful for the treatment neurodegenerative diseases ARES TRADING S.A. (CH) 2016-01-12 US disclosed
US-20150111882-A1 SPIRO TETRAHYDRO - BENZOTHIOPHEN DERIVATIVES USEFUL FOR THE TREATMENT NEURODEGENERATIVE DISEASES ARES TRADING S.A. (CH) 2015-04-23 US disclosed
US-20150111882-A1 SPIRO TETRAHYDRO - BENZOTHIOPHEN DERIVATIVES USEFUL FOR THE TREATMENT NEURODEGENERATIVE DISEASES ARES TRADING S.A. (CH) 2015-04-23 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150111882-A1 SPIRO TETRAHYDRO - BENZOTHIOPHEN DERIVATIVES USEFUL FOR THE TREATMENT NEURODEGENERATIVE DISEASES PSEN1, PSEN2, BACE2 BACE1 4/4885CTSD 1626/4885KCNH2 4067/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.