SCHEMBL31307015

SCHEMBL31307015

Nc1c[nH]c2cccnc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSMD14 O00487 1/20 0.48
GRM4 Q14833 2/20 0.43
NUDT1 P36639 1/20 0.41
HSP90AA1 P07900 3/20 0.40
HSP90AB1 P08238 2/20 0.40
IDO1 P14902 1/20 0.40
PSMB5 P28074 1/20 0.40
PRKD3 O94806 1/20 0.40
PRKD1 Q15139 1/20 0.40
PRKD2 Q9BZL6 1/20 0.40
MAPT P10636 2/20 0.39
MEN1 O00255 1/20 0.39
APAF1 O14727 1/20 0.39
TDP2 O95551 1/20 0.39
ALDH1A1 P00352 1/20 0.39
CASP3 P42574 1/20 0.39
KMT2A Q03164 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39

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
SCHEMBL3175822 1.00 PSMD14 (0.48) PSMD14GRM4NUDT1HSP90AA1HSP90AB1
Hydrochloric Acid SCHEMBL30175987 0.98 PSMD14 (0.47) PSMD14GRM4NUDT1HSP90AA1HSP90AB1
Hydrochloric Acid SCHEMBL29438980 0.98 PSMD14 (0.47) PSMD14GRM4NUDT1HSP90AA1HSP90AB1
Hydrochloric Acid SCHEMBL21988111 0.98 PSMD14 (0.47) PSMD14GRM4NUDT1HSP90AA1HSP90AB1
SCHEMBL13978041 0.75 PSMD14 (0.48) PSMD14GRM4HSP90AA1PRKD3PRKD1
SCHEMBL22510135 0.75 PSMD14 (0.48) PSMD14GRM4HSP90AA1MAPTLMNA
SCHEMBL2066259 0.75 PSMD14 (0.48) PSMD14GRM4HSP90AA1HSP90AB1IDO1
SCHEMBL19100792 0.75 GRM4 (0.54) PSMD14GRM4HSP90AA1MAPTMEN1
SCHEMBL569155 0.75 AXL (0.50) PSMD14GRM4HSP90AA1PRKD3PRKD1
SCHEMBL29364091 0.75 AXL (0.50) PSMD14GRM4HSP90AA1PRKD3PRKD1

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
CN-120004785-A Compounds and compositions for the treatment of diseases associated with STING activity 诺华制药股份有限公司 2025-05-16 CN disclosed
CN-112823036-B Compounds and compositions for the treatment of diseases associated with STING activity 艾福姆德尤股份有限公司 2024-11-08 CN disclosed