SCHEMBL30954380

SCHEMBL30954380

Cc1cc(F)c(-c2cc(Nc3cnc(C#N)cn3)n[nH]2)c(O[C@@H]2CCC[C@H]2NC(=O)OC(C)(C)C)c1

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 10/20 0.48
CHEK1 O14757 19/20 0.47

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
SCHEMBL27280639 1.00 KCNH2 (0.48) KCNH2CHEK1
SCHEMBL30954381 1.00 KCNH2 (0.48) KCNH2CHEK1
SCHEMBL30800450 0.86 CHEK1 (0.56) KCNH2CHEK1
SCHEMBL24978463 0.86 CHEK1 (0.56) KCNH2CHEK1
SCHEMBL30101672 0.86 CHEK1 (0.56) KCNH2CHEK1
SCHEMBL30954374 0.84 CHEK1 (0.55) KCNH2CHEK1
SCHEMBL27280642 0.84 CHEK1 (0.55) KCNH2CHEK1
SCHEMBL27280618 0.81 CHEK1 (0.58) KCNH2CHEK1
SCHEMBL30954377 0.80 MAPK1 (0.34)
SCHEMBL30954378 0.80 MAPK1 (0.34)

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-2024118564-A1 CHECKPOINT KINASE 1 (CHK1) INHIBITORS AND USES THEREOF BOUNDLESS BIO, INC. (US) 2024-06-06 WO disclosed