SCHEMBL17260356

SCHEMBL17260356

COc1ccc(C2CC(c3cccc(-c4cncnc4)c3)N=C(N)S2)cc1OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 9/20 1.00
BCHE P06276 1/20 0.38
TACR1 P25103 1/20 0.35
FPR2 P25090 2/20 0.35
REN P00797 1/20 0.35
CTSD P07339 1/20 0.35
BACE2 Q9Y5Z0 1/20 0.35
FYN P06241 2/20 0.34
RAB9A P51151 1/20 0.34
KCNH2 Q12809 1/20 0.34
ALDH1A1 P00352 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL15839684 1.00 BACE1 (1.00) BACE1BCHETACR1FPR2REN
SCHEMBL15839628 0.88 BACE1 (0.78) BACE1CTSDBACE2KCNH2
SCHEMBL17260359 0.88 BACE1 (0.78) BACE1CTSDBACE2KCNH2
SCHEMBL15839630 0.88 BACE1 (0.78) BACE1KCNH2
SCHEMBL15839626 0.86 BACE1 (0.75) BACE1BCHETACR1FPR2REN
SCHEMBL15826211 0.85 BACE1 (0.74) BACE1BACE2KCNH2
SCHEMBL15825505 0.84 BACE1 (0.81) BACE1RENCTSDBACE2ALDH1A1
SCHEMBL15826155 0.84 BACE1 (0.78) BACE1TACR1ALDH1A1
SCHEMBL15825666 0.84 BACE1 (0.78) BACE1TACR1ALDH1A1
SCHEMBL15839685 0.84 BACE1 (0.81) BACE1RENCTSDBACE2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2935256-B1 4,6-DIARYLAMINOTHIAZINES AS BACE1 INHIBITORS AND THEIR USE FOR THE REDUCTION OF BETA-AMYLOID PRODUCTION BRISTOL MYERS SQUIBB CO (US) 2018-01-24 EP disclosed
US-9475784-B2 4,6-diarylaminothiazines as BACE1 inhibitors and their use for the reduction of beta-amyloid production BRISTOL-MYERS SQUIBB COMPANY (US) 2016-10-25 US disclosed
US-20150329506-A1 4,6-DIARYLAMINOTHIAZINES AS BACE1 INHIBITORS AND THEIR USE FOR THE REDUCTION OF BETA-AMYLOID PRODUCTION BRISTOL-MYERS SQUIBB COMPANY (US) 2015-11-19 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-20150329506-A1 4,6-DIARYLAMINOTHIAZINES AS BACE1 INHIBITORS AND THEIR USE FOR THE REDUCTION OF BETA-AMYLOID PRODUCTION BACE1, APP, BACE2 BACE1 1/4885BCHE 79/4885TACR1 2061/4885

“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.