SCHEMBL30107189

SCHEMBL30107189

CC(C)C(=O)Nc1cc2cc(Cl)nc(N)c2cn1

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAP4K1 Q92918 17/20 0.59
SCN10A Q9Y5Y9 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ABL1 P00519 1/20 0.41

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
SCHEMBL20519271 1.00 MAP4K1 (0.59) MAP4K1SCN10ANPC1RAB9ASMN1; SMN2
SCHEMBL30107537 0.87 MAP4K1 (0.63) MAP4K1
SCHEMBL20519023 0.87 MAP4K1 (0.63) MAP4K1
SCHEMBL20519989 0.86 MAP4K1 (0.47) MAP4K1NPC1RAB9ASMN1; SMN2ABL1
SCHEMBL30107505 0.86 MAP4K1 (0.47) MAP4K1NPC1RAB9ASMN1; SMN2ABL1
SCHEMBL30107354 0.85 L3MBTL1 (0.47) MAP4K1
SCHEMBL20519528 0.85 L3MBTL1 (0.47) MAP4K1
SCHEMBL20519457 0.83 MAP4K1 (0.60) MAP4K1ABL1
SCHEMBL30107242 0.83 MAP4K1 (0.60) MAP4K1ABL1
SCHEMBL20519263 0.81 MAP4K1 (0.60) MAP4K1

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-110678466-B Diazanaphthalenes as HPK1 inhibitors 豪夫迈·罗氏有限公司 2023-01-31 CN disclosed