SCHEMBL31379262

SCHEMBL31379262

Cc1nnc(CC(=O)C(C)C)o1

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
CYP1A2 P05177 1/20 0.33
HSD17B10 Q99714 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CCNE1 P24864 1/20 0.31
CDK2 P24941 1/20 0.31
GPR88 Q9GZN0 1/20 0.30
HDAC8 Q9BY41 1/20 0.30
CTSA P10619 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
SCHEMBL22572020 0.81 ALDH1A1 (0.35) NPC1RAB9AKMT2ASMN1; SMN2
SCHEMBL15332460 0.78 HSD17B10 (0.46) NPC1RAB9AHSD17B10KMT2ASMN1; SMN2
SCHEMBL3432268 0.78 NPC1 (0.36) NPC1RAB9AHSD17B10KMT2ASMN1; SMN2
SCHEMBL22723879 0.76 HTT (0.38) NPC1RAB9AHSD17B10KMT2ASMN1; SMN2
SCHEMBL20572656 0.74 NPC1 (0.35) NPC1RAB9AHSD17B10KMT2ASMN1; SMN2
Potassium Ion SCHEMBL31377889 0.74 NPC1 (0.35) NPC1RAB9AHSD17B10KMT2ASMN1; SMN2
SCHEMBL31377840 0.74 SMN1; SMN2 (0.36) NPC1RAB9AHSD17B10KMT2ASMN1; SMN2
Lithium Ion SCHEMBL17726187 0.74 NPC1 (0.35) NPC1RAB9AHSD17B10KMT2ASMN1; SMN2
SCHEMBL21423701 0.73 NPC1 (0.37) NPC1RAB9AHSD17B10KMT2ASMN1; SMN2
SCHEMBL12862987 0.73 HDAC8 (0.48) NPC1RAB9AKMT2AGPR88HDAC8

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-4743175-A1 COMPOUNDS, COMPOSITIONS, AND METHODS Aconcagua Bio, Inc. (US) 2026-05-20 EP disclosed
US-20250051355-A1 COMPOUNDS, COMPOSITIONS, AND METHODS ACONCAGUA BIO, INC. 2025-02-13 US disclosed
WO-2025015269-A1 COMPOUNDS, COMPOSITIONS, AND METHODS ACONCAGUA BIO, INC. (US) 2025-01-16 WO 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-20250051355-A1 COMPOUNDS, COMPOSITIONS, AND METHODS IAPP, GIPR, GPR119 NPC1 383/4885RAB9A 1502/4885CYP1A2 4686/4885

“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.