SCHEMBL21883548

SCHEMBL21883548

CSc1cccc(C=N)c1O

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.36
ALOX5 P09917 1/20 0.35
ERN1 O75460 3/20 0.32
TLR2 O60603 1/20 0.32
TLR1 Q15399 1/20 0.32
TLR6 Q9Y2C9 1/20 0.32
POLB P06746 1/20 0.31
GAA P10253 1/20 0.31
RAB9A P51151 1/20 0.31
IAPP P10997 1/20 0.31
ABCB1 P08183 1/20 0.31
ALOX12 P18054 1/20 0.30
ALDH1A1 P00352 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
SCHEMBL986274 0.80 ERN1 (0.55) BACE1ALOX5ERN1TLR2TLR1
SCHEMBL10071683 0.79 ALOX5 (0.42) BACE1ALOX5POLBRAB9AABCB1
SCHEMBL199801 0.78 GABRA1 (0.42) ALOX12ALDH1A1
SCHEMBL19782076 0.72 ALDH1A1 (0.56) ERN1POLBGAARAB9AALOX12
SCHEMBL14337060 0.72 SIRT2 (0.51) POLBRAB9AALDH1A1
SCHEMBL14899338 0.72 ERN1 (0.60) ERN1POLBGAARAB9AIAPP
SCHEMBL5090901 0.72 GABRA1 (0.43) ERN1TLR2TLR1TLR6POLB
SCHEMBL2834212 0.72 ALDH1A1 (0.52) ERN1POLBGAARAB9AIAPP
SCHEMBL31550782 0.72 ALDH1A1 (0.52) ERN1POLBGAARAB9AIAPP
SCHEMBL20809969 0.68 MAPT (0.46) POLBRAB9AALOX12ALDH1A1

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-10597377-B2 Somatostatin modulators and uses thereof Crinetics Pharmaceuticals, Inc. (US) 2020-03-24 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-10597377-B2 Somatostatin modulators and uses thereof SSTR5, SSTR2, SSTR4 BACE1 1287/4885ALOX5 1239/4885ERN1 2959/4885

“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.