SCHEMBL31461658

SCHEMBL31461658

CCOC(=O)c1cc2c3ccccc3nc(C)n2n1

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 2/20 0.61
PDE10A Q9Y233 2/20 0.56
ALOX15 P16050 1/20 0.50
ELANE P08246 4/20 0.48
KMT2A Q03164 2/20 0.46
GAA P10253 1/20 0.46
CYP1A2 P05177 1/20 0.46
MEN1 O00255 1/20 0.45
LMNA P02545 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
F2 P00734 1/20 0.45
PLAU P00749 1/20 0.45

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
SCHEMBL18304834 0.88 ADORA3 (0.58) ADORA3PDE10AALOX15ELANEKMT2A
SCHEMBL11474094 0.84 ALOX15 (0.46) ADORA3PDE10AALOX15LMNA
SCHEMBL11266931 0.76 ADORA3 (1.00) ADORA3LMNASMN1; SMN2
SCHEMBL11582254 0.75 ALOX15 (0.56) ALOX15ELANEKMT2AGAACYP1A2
SCHEMBL11391453 0.75 ADORA3 (0.77) ADORA3PDE10AKMT2AMEN1LMNA
SCHEMBL6889759 0.74 ALDH1A1 (0.61) KMT2AGAACYP1A2MEN1LMNA
SCHEMBL1733527 0.73 SMN1; SMN2 (0.54) ALOX15KMT2AGAACYP1A2MEN1
SCHEMBL31461727 0.73 TSHR (0.42) PDE10AKMT2AGAAMEN1LMNA
SCHEMBL30002312 0.73 SMN1; SMN2 (0.54) ALOX15KMT2AGAACYP1A2MEN1
SCHEMBL31410807 0.73 ADORA3 (0.47) ADORA3PDE10AELANEKMT2AGAA

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
WO-2025024543-A1 TRICYCLIC UBE2K MODULATORS AND METHODS FOR THEIR USE BPGBIO, INC. (US) 2025-01-30 WO disclosed