SCHEMBL30470644

SCHEMBL30470644

C[C@H]1CCC(c2ccc3sc(C4CCN(C)C(=O)C4)nc3c2)=NC1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
TP53 P04637 2/20 0.39
UBE2M P61081 5/20 0.33
DCUN1D1 Q96GG9 5/20 0.33
PDE10A Q9Y233 1/20 0.33
LMNA P02545 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MAP3K12 Q12852 1/20 0.32
BRD4 O60885 2/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32
DRD2 P14416 1/20 0.32
DRD4 P21917 1/20 0.32
GRM2 Q14416 1/20 0.32

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
SCHEMBL29081450 1.00 ALDH1A1 (0.39) ALDH1A1TP53UBE2MDCUN1D1PDE10A
SCHEMBL24366673 1.00 ALDH1A1 (0.39) ALDH1A1TP53UBE2MDCUN1D1PDE10A
SCHEMBL24233756 0.86 NPC1 (0.37) ALDH1A1TP53UBE2MDCUN1D1LMNA
SCHEMBL24363794 0.86 NPC1 (0.37) ALDH1A1TP53UBE2MDCUN1D1LMNA
SCHEMBL25324407 0.84 NPC1 (0.34) ALDH1A1TP53UBE2MDCUN1D1LMNA
SCHEMBL30551016 0.84 NPC1 (0.34) ALDH1A1TP53UBE2MDCUN1D1LMNA
SCHEMBL24233907 0.83 NPC1 (0.37) ALDH1A1TP53UBE2MDCUN1D1LMNA
SCHEMBL32689340 0.83 NPC1 (0.36) ALDH1A1TP53UBE2MDCUN1D1LMNA
SCHEMBL24365738 0.83 NPC1 (0.36) ALDH1A1TP53UBE2MDCUN1D1LMNA
SCHEMBL29081416 0.83 NPC1 (0.36) ALDH1A1TP53UBE2MDCUN1D1LMNA

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-20260078117-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS INC (US) 2026-03-19 US disclosed
EP-4469455-A1 COMPOUNDS AND METHODS OF USE Tango Therapeutics, Inc. (US) 2024-12-04 EP disclosed
WO-2023146990-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. (US) 2023-08-03 WO disclosed
EP-4188920-A1 PIPERIDIN-1-YL-N-PYRYDINE-3-YL-2-OXOACETAMIDE DERIVATIVES USEFUL FOR THE TREATMENT OF MTAP-DEFICIENT AND/OR MTA-ACCUMULATING CANCERS Tango Therapeutics, Inc. (US) 2023-06-07 EP 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-20260078117-A1 COMPOUNDS AND METHODS OF USE NR3C2, ADRA1A, CNR1 ALDH1A1 100/4885TP53 3467/4885UBE2M 3818/4885

“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.