SCHEMBL17286649

SCHEMBL17286649

N#Cc1ccc(C2COCC3=C2NC(O)NC3=O)cc1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 1/20 0.32
GAA P10253 1/20 0.31
KCNH2 Q12809 1/20 0.31
MGLL Q99685 1/20 0.30
NSD2 O96028 1/20 0.30
MAPKAPK2 P49137 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
SCHEMBL17286650 0.80 KCNH2 (0.32) CYP11B2GAAKCNH2
SCHEMBL512148 0.67 CYP11B2 (0.34) CYP11B2KCNH2
SCHEMBL513482 0.65 NOS3 (0.37) CYP11B2KCNH2MAPKAPK2
SCHEMBL1226443 0.65 NOS3 (0.37) CYP11B2KCNH2MAPKAPK2
SCHEMBL512418 0.65 PRKDC (0.38) CYP11B2KCNH2MGLLNSD2
SCHEMBL26141852 0.59 CA2 (0.44)
SCHEMBL19741202 0.59 KCNH2 (0.41) KCNH2MGLL
SCHEMBL19820143 0.58 HDAC2 (0.42)
SCHEMBL9627406 0.57 CA2 (0.39) KCNH2
SCHEMBL1226208 0.57 TSHR (0.50)

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
US-20150336975-A1 COMPOUNDS FOR THE REDUCTION OF BETA-AMYLOID PRODUCTION BRISTOL-MYERS SQUIBB COMPANY (US) 2015-11-26 US disclosed
US-20150336975-A1 COMPOUNDS FOR THE REDUCTION OF BETA-AMYLOID PRODUCTION BRISTOL-MYERS SQUIBB COMPANY (US) 2015-11-26 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-20150336975-A1 COMPOUNDS FOR THE REDUCTION OF BETA-AMYLOID PRODUCTION APP, BACE1, IAPP CYP11B2 200/4885GAA 66/4885KCNH2 4707/4885

“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.