SCHEMBL22710175

SCHEMBL22710175

CCCCc1cc(-c2ccn(C)n2)ccc1NC=O

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 1/20 0.45
▸ KEAP1 Q14145 1/20 0.36
▸ KMT2A Q03164 1/20 0.35
▸ PIK3CD O00329 1/20 0.34
▸ PIP5K1C O60331 1/20 0.34
▸ PIK3CA P42336 1/20 0.34
▸ PIK3CB P42338 1/20 0.34
▸ PI4KA P42356 1/20 0.34
▸ PIK3CG P48736 1/20 0.34
▸ PI4KB Q9UBF8 1/20 0.34
▸ P2RX7 Q99572 1/20 0.33
▸ MKNK1 Q9BUB5 1/20 0.33
▸ MKNK2 Q9HBH9 1/20 0.33
▸ USP30 Q70CQ3 1/20 0.32
▸ SCN4A P35499 1/20 0.32
▸ TYK2 P29597 1/20 0.32
▸ JMJD6 Q6NYC1 2/20 0.31
▸ DYRK1A Q13627 1/20 0.31

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
SCHEMBL18300032 0.74 TTK (0.43) CYP19A1KEAP1KMT2APIK3CDPIP5K1C
SCHEMBL22887810 0.72 CTRC (0.37) KMT2A
SCHEMBL17580555 0.72 SYK (0.38) CYP19A1KEAP1KMT2APIK3CDPIP5K1C
SCHEMBL19980262 0.70 ABCC9 (0.38) KMT2A
SCHEMBL14390806 0.68 CYP3A4 (0.44) —
SCHEMBL15507765 0.67 FYN (0.50) PIK3CDPIK3CAPIK3CBPI4KAPIK3CG
SCHEMBL30132283 0.67 FYN (0.50) PIK3CDPIK3CAPIK3CBPI4KAPIK3CG
SCHEMBL19037395 0.65 TLR8 (0.32) —
SCHEMBL7527064 0.65 SKP2 (0.51) KMT2A
SCHEMBL21156942 0.64 POLB (0.37) KMT2A

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
EP-3342771-B1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2020-11-25 — — EP disclosed
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