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SCHEMBL5314910

SCHEMBL5314910

Cc1ccc(N(C)c2ccc3nc(Nc4cc(C(=O)N5CC[C@@H](N)C5)ccn4)sc3n2)cc1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PROKR1 Q8TCW9 10/20 0.39
▸ KDM1A O60341 4/20 0.38
▸ MAP3K12 Q12852 2/20 0.36
▸ HCK P08631 2/20 0.35
▸ BTK Q06187 2/20 0.35
▸ SYK P43405 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
SCHEMBL5312309 1.00 PROKR1 (0.39) PROKR1KDM1AMAP3K12HCKBTK
SCHEMBL5312760 0.95 PROKR1 (0.37) PROKR1KDM1AMAP3K12HCKBTK
SCHEMBL14531392 0.92 PROKR1 (0.40) PROKR1MAP3K12HCKBTKSYK
SCHEMBL5310631 0.91 PROKR1 (0.40) PROKR1MAP3K12HCKBTKSYK
SCHEMBL5310717 0.89 IKBKB (0.40) PROKR1MAP3K12SYK
SCHEMBL5312669 0.89 HCK (0.38) PROKR1HCKBTKSYK
SCHEMBL5334096 0.89 HCK (0.38) PROKR1HCKBTKSYK
SCHEMBL5312665 0.89 HCK (0.38) PROKR1HCKBTKSYK
SCHEMBL5328608 0.88 MAP3K12 (0.37) KDM1AMAP3K12HCKBTKSYK
SCHEMBL5328587 0.88 MAP3K12 (0.37) KDM1AMAP3K12HCKBTKSYK

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-2007058482-A1 NOVEL INHIBITORS OF PROTEIN KINASE LG LIFE SCIENCES, LTD. (KR) 2007-05-24 — — WO claimed
WO-2007058482-A1 NOVEL INHIBITORS OF PROTEIN KINASE LG LIFE SCIENCES, LTD. (KR) 2007-05-24 — — WO disclosed