SCHEMBL369277

SCHEMBL369277

Nc1ccc(-n2cnc(Cl)c2)c(OCCCNc2nc(Cl)nc3c2CCC3c2ccccc2)c1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
UGT1A1 P22309 1/20 0.52
KCNH2 Q12809 1/20 0.52
SLCO1B1 Q9Y6L6 1/20 0.52
PSEN1 P49768 10/20 0.34
PSEN2 P49810 10/20 0.34
APH1B Q8WW43 10/20 0.34
NCSTN Q92542 10/20 0.34
APH1A Q96BI3 10/20 0.34
PSENEN Q9NZ42 10/20 0.34

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
SCHEMBL368500 0.93 UGT1A1 (0.51) UGT1A1KCNH2SLCO1B1PSEN1PSEN2
SCHEMBL18023082 0.91 UGT1A1 (0.54) UGT1A1KCNH2SLCO1B1PSEN1PSEN2
SCHEMBL10279333 0.90 UGT1A1 (0.53) UGT1A1KCNH2SLCO1B1PSEN1PSEN2
SCHEMBL367898 0.88 UGT1A1 (0.49) UGT1A1KCNH2SLCO1B1PSEN1PSEN2
SCHEMBL369451 0.84 UGT1A1 (0.48) UGT1A1KCNH2SLCO1B1PSEN1PSEN2
SCHEMBL10356245 0.83 UGT1A1 (0.51) UGT1A1KCNH2SLCO1B1PSEN1PSEN2
SCHEMBL369543 0.81 UGT1A1 (0.48) UGT1A1KCNH2SLCO1B1PSEN1PSEN2
SCHEMBL360429 0.80 ACHE (0.37) UGT1A1KCNH2SLCO1B1PSEN1PSEN2
SCHEMBL10352841 0.79 UGT1A1 (0.33) UGT1A1KCNH2SLCO1B1
SCHEMBL18023089 0.77 UGT1A1 (0.38) UGT1A1KCNH2SLCO1B1PSEN1PSEN2

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-8637523-B2 Compounds for the reduction of beta-amyloid production BRISTOL-MYERS SQUIBB COMPANY (US) 2014-01-28 US disclosed
US-8637523-B2 Compounds for the reduction of beta-amyloid production BRISTOL-MYERS SQUIBB COMPANY (US) 2014-01-28 US disclosed
US-20120184565-A1 COMPOUNDS FOR THE REDUCTION OF BETA-AMYLOID PRODUCTION BRISTOL-MYERS SQUIBB COMPANY 2012-07-19 US disclosed
US-20120184565-A1 COMPOUNDS FOR THE REDUCTION OF BETA-AMYLOID PRODUCTION BRISTOL-MYERS SQUIBB COMPANY 2012-07-19 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-20120184565-A1 COMPOUNDS FOR THE REDUCTION OF BETA-AMYLOID PRODUCTION APP, BACE1, IAPP UGT1A1 2634/4885KCNH2 4384/4885SLCO1B1 2215/4885

“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.