SCHEMBL27273135

SCHEMBL27273135

Cc1c(C(=O)Cl)sc2nc[nH]c(=O)c12

nearest known ligand 0.76

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
BCAT2 O15382 6/20 0.76
HPGD P15428 4/20 0.70
KDM4E B2RXH2 4/20 0.67
LMNA P02545 2/20 0.67
GAA P10253 1/20 0.67
ALDH1A1 P00352 2/20 0.65
POLB P06746 1/20 0.65
PDPK1 O15530 1/20 0.62
HTT P42858 1/20 0.61
BLM P54132 1/20 0.61
THRB P10828 3/20 0.58
HSD17B10 Q99714 1/20 0.58
MAPT P10636 5/20 0.57
TP53 P04637 2/20 0.57
CYP1A2 P05177 1/20 0.56
CYP3A4 P08684 1/20 0.56
CYP2C19 P33261 1/20 0.56

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
SCHEMBL263739 0.86 BCAT2 (1.00) BCAT2HPGDKDM4ELMNAGAA
SCHEMBL19119395 0.85 BCAT2 (0.76) BCAT2HPGDKDM4ELMNAGAA
SCHEMBL23209156 0.82 BCAT2 (0.72) BCAT2HPGDKDM4ELMNAGAA
SCHEMBL265344 0.82 HPGD (1.00) BCAT2HPGDKDM4ELMNAGAA
SCHEMBL23267317 0.81 BCAT2 (0.70) BCAT2HPGDKDM4ELMNAGAA
SCHEMBL263943 0.80 KDM4E (1.00) BCAT2HPGDKDM4ELMNAGAA
SCHEMBL264414 0.78 BCAT2 (0.65) BCAT2HPGDKDM4ELMNAGAA
SCHEMBL12318281 0.78 PDPK1 (0.70) BCAT2HPGDKDM4ELMNAGAA
SCHEMBL25908842 0.77 PDPK1 (1.00) BCAT2HPGDKDM4ELMNAGAA
SCHEMBL30987724 0.76 BCAT2 (0.44) BCAT2HPGDKDM4ELMNAGAA

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-2024133560-A1 IMIDAZO[1,2-A]PYRIDINE AND IMIDAZO[1,2-A]PYRAZINE DERIVATIVES AS MLLT1 AND MLLT3 INHIBITORS DARK BLUE THERAPEUTICS LTD (GB) 2024-06-27 WO disclosed