SCHEMBL24651142

SCHEMBL24651142

CC(C)n1nc(-c2ccc3c(c2Cl)CCN3)c2c(N)ncnc21

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 17/20 0.52
▸ ABL1 P00519 16/20 0.52
▸ KDR P35968 15/20 0.52
▸ PIK3CD O00329 14/20 0.52
▸ EGFR P00533 14/20 0.52
▸ HCK P08631 14/20 0.52
▸ PIK3CA P42336 14/20 0.52
▸ PIK3CB P42338 14/20 0.52
▸ MTOR P42345 14/20 0.52
▸ PIK3CG P48736 14/20 0.52
▸ EPHB4 P54760 14/20 0.52
▸ PRKDC P78527 14/20 0.52
▸ PI4KB Q9UBF8 9/20 0.52
▸ RET P07949 3/20 0.52

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
SCHEMBL30120787 1.00 SRC (0.52) SRCABL1KDRPIK3CDEGFR
SCHEMBL30120814 0.88 SRC (0.59) SRCABL1KDRPIK3CDEGFR
SCHEMBL24651153 0.88 SRC (0.59) SRCABL1KDRPIK3CDEGFR
SCHEMBL30120839 0.82 KDR (0.50) SRCABL1KDRPIK3CDEGFR
SCHEMBL24650649 0.82 KDR (0.50) SRCABL1KDRPIK3CDEGFR
SCHEMBL24651165 0.79 KDR (0.49) SRCABL1KDRPIK3CDEGFR
SCHEMBL30121083 0.79 KDR (0.49) SRCABL1KDRPIK3CDEGFR
SCHEMBL27889174 0.77 EIF2AK3 (0.40) SRCKDRRET
Hydrochloric Acid SCHEMBL868325 0.76 EIF2AK3 (0.39) SRCKDRRET
SCHEMBL24650658 0.72 SRC (0.53) SRCABL1EGFRRET

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
WO-2022212326-A1 NEK7 INHIBITORS Halia Therapeutics, Inc. (US) 2022-10-06 — — WO disclosed
Send feedback