SCHEMBL30217893

SCHEMBL30217893

CCCc1cc(=O)n2nc(SC)nc2[nH]1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.46
HSD17B10 Q99714 2/20 0.46
ALDH1A1 P00352 1/20 0.46
HPGD P15428 1/20 0.46
RAB9A P51151 1/20 0.46
MAPK10 P53779 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ADORA1 P30542 2/20 0.38
ADORA2A P29274 1/20 0.38
MPO P05164 1/20 0.36
TPO P07202 1/20 0.36
TSHR P16473 1/20 0.36
LPO P22079 1/20 0.36
CYP2C19 P33261 1/20 0.36
TAS2R38 P59533 1/20 0.36
CDK4 P11802 1/20 0.33
CCND1 P24385 1/20 0.33
CYP1A2 P05177 1/20 0.32
KDM5B Q9UGL1 3/20 0.32
KDM5A P29375 2/20 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
SCHEMBL21681604 0.81 KDM4E (0.49) KDM4EHSD17B10ALDH1A1HPGDRAB9A
SCHEMBL26662250 0.80 KDM4E (0.48) KDM4EHSD17B10ALDH1A1HPGDRAB9A
SCHEMBL16691060 0.78 MAPT (0.41) KDM4EHSD17B10ALDH1A1HPGDRAB9A
SCHEMBL26662277 0.77 KDM4E (0.45) KDM4EHSD17B10ALDH1A1HPGDRAB9A
SCHEMBL20076031 0.73 KDM4E (0.41) KDM4EHSD17B10ALDH1A1HPGDRAB9A
SCHEMBL20074182 0.71 ALDH1A1 (0.47) KDM4EHSD17B10ALDH1A1HPGDRAB9A
SCHEMBL20160759 0.70 KDM4E (0.47) KDM4EHSD17B10ALDH1A1HPGDRAB9A
SCHEMBL23062819 0.70 SMN1; SMN2 (0.41) KDM4EHSD17B10ALDH1A1HPGDRAB9A
SCHEMBL20075837 0.69 KDM4E (0.36) KDM4EHSD17B10ALDH1A1HPGDRAB9A
SCHEMBL23271256 0.69 SMN1; SMN2 (0.41) KDM4EHSD17B10ALDH1A1HPGDRAB9A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4153593-A1 CGAS INHIBITING TRIAZOLOPYRIMIDONE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2023-03-29 EP disclosed
CN-115667265-A CGAS-inhibiting triazolopyrimidinone derivatives 豪夫迈·罗氏有限公司 2023-01-31 CN disclosed