SCHEMBL30349340

SCHEMBL30349340

CCOC(=O)c1cnn2c(NCc3ccc(OC)cc3)cc(Nc3ccccc3OC)nc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA3 P0DMS8 2/20 0.48
▸ ADORA2A P29274 2/20 0.48
▸ ADORA2B P29275 2/20 0.48
▸ ADORA1 P30542 2/20 0.48
▸ CCNA2 P20248 1/20 0.47
▸ CDK2 P24941 1/20 0.47
▸ TYK2 P29597 2/20 0.47
▸ STAT3 P40763 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ MEN1 O00255 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ MAPT P10636 7/20 0.45
▸ SMN1; SMN2 Q16637 3/20 0.45
▸ USP2 O75604 1/20 0.45
▸ ALOX15 P16050 1/20 0.45
▸ TSHR P16473 1/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45
▸ POLB P06746 2/20 0.45
▸ ALDH1A1 P00352 3/20 0.44
▸ KDM4E B2RXH2 2/20 0.44

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
SCHEMBL30349474 0.91 TYK2 (0.50) ADORA3ADORA2AADORA1CDK2TYK2
SCHEMBL30349558 0.86 TYK2 (0.61) TYK2STAT3MAPTSMN1; SMN2USP2
SCHEMBL21811191 0.86 TYK2 (0.61) TYK2STAT3MAPTSMN1; SMN2USP2
SCHEMBL21887777 0.84 MAPT (0.44) ADORA3ADORA2AADORA2BADORA1CCNA2
SCHEMBL30378065 0.83 TYK2 (0.50) ADORA3ADORA2AADORA2BADORA1CCNA2
SCHEMBL30349310 0.83 CCNA2 (0.54) ADORA3ADORA2AADORA2BADORA1CCNA2
SCHEMBL30349442 0.80 TYK2 (0.77) TYK2STAT3
SCHEMBL21887781 0.79 NPSR1 (0.43) ADORA3ADORA2AADORA2BADORA1GAA
SCHEMBL21887788 0.79 TYK2 (0.53) TYK2STAT3SMN1; SMN2ALOX15TSHR
SCHEMBL30377589 0.78 POLB (0.51) ADORA3ADORA2AADORA1CDK2MEN1

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
CN-112638915-B Pyrazolo [1,5-a ] pyrimidine-3-carboxamide derivatives for the treatment of psoriasis and systemic lupus erythematosus 伊莱利利公司 2023-04-07 — — CN disclosed
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