SCHEMBL26105897

SCHEMBL26105897

Fc1ccc(-c2n[nH]cc2-c2ncnc3oc(-c4ccccc4)nc23)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 6/20 0.40
ADK P55263 6/20 0.39
USP1 O94782 1/20 0.38
USP19 O94966 1/20 0.38
UCHL3 P15374 1/20 0.38
ADORA1 P30542 1/20 0.36
PTGS2 P35354 1/20 0.36
JAK2 O60674 1/20 0.35
JAK3 P52333 1/20 0.35
EGFR P00533 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35
HPGD P15428 1/20 0.35
CYP2C19 P33261 1/20 0.35
PTK2B Q14289 1/20 0.35
MAPK13 O15264 2/20 0.34
GCGR P47871 2/20 0.34
MAPK12 P53778 2/20 0.34
MAPK11 Q15759 2/20 0.34
ALOX5 P09917 1/20 0.34

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
SCHEMBL26104108 0.77 EGFR (0.49) EGFRCYP1A2CYP2C9HPGDCYP2C19
SCHEMBL26100535 0.74 PTGS2 (0.37) MAPK14ADKPTGS2
SCHEMBL14519679 0.73 JAK3 (0.41) MAPK14JAK2JAK3MAPK13MAPK12
SCHEMBL26103887 0.73 KIT (0.39) MAPK14JAK2JAK3EGFR
SCHEMBL28329372 0.72 ADORA1 (0.49) MAPK14ADORA1MAPK13GCGRMAPK12
SCHEMBL26102662 0.72 KIT (0.37) MAPK14
SCHEMBL26103471 0.72 KIT (0.38) MAPK14JAK2JAK3EGFR
SCHEMBL652979 0.69 NPC1 (0.44) MAPK14ADKUSP1USP19UCHL3
SCHEMBL30362002 0.67 ADORA1 (0.38) MAPK14USP1ADORA1EGFRCYP1A2
SCHEMBL7856946 0.67 TGFBR1 (0.51) MAPK14CYP1A2

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
WO-2023076849-A1 INHIBITORS OF EPIDERMAL GROWTH FACTOR RECEPTOR ORIC PHARMACEUTICALS, INC. (US) 2023-05-04 WO disclosed
WO-2023076849-A1 INHIBITORS OF EPIDERMAL GROWTH FACTOR RECEPTOR ORIC PHARMACEUTICALS, INC. (US) 2023-05-04 WO disclosed