SCHEMBL26047950

SCHEMBL26047950

CCC(C)c1cc(Nc2ccnc(NCCCN(C)C)n2)n[nH]1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 10/20 0.49
DNM2 P50570 2/20 0.48
AURKA O14965 1/20 0.41
PAK4 O96013 1/20 0.41
PAK1 Q13153 1/20 0.41
FGFR1 P11362 2/20 0.41
KDR P35968 2/20 0.41
PKN1 Q16512 1/20 0.40
CCNK O75909 1/20 0.39
CDK13 Q14004 1/20 0.39
CDK12 Q9NYV4 1/20 0.39
CCR4 P51679 1/20 0.39

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
SCHEMBL25371017 0.78 IGF1R (0.68) IGF1RPAK4PAK1CCNKCDK13
SCHEMBL30558769 0.78 IGF1R (0.68) IGF1RPAK4PAK1CCNKCDK13
SCHEMBL19477221 0.72 DNM2 (0.80) DNM2CCR4
SCHEMBL19476566 0.72 DNM2 (0.80) DNM2CCR4
SCHEMBL25370935 0.68 IGF1R (0.59) IGF1RPAK4PAK1CCNKCDK13
SCHEMBL2947094 0.68 DNM2 (0.90) DNM2CCR4
SCHEMBL4017963 0.66 IGF1R (1.00) IGF1RFGFR1KDR
SCHEMBL12487500 0.66 DNM2 (0.53) DNM2CCR4
SCHEMBL26047955 0.65 CCNK (0.66) IGF1RPAK4PAK1CCNKCDK13
SCHEMBL25368424 0.65 IGF1R (0.54) IGF1RPAK4PAK1CCNKCDK13

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-2023164611-A1 MODULATORS OF MYC FAMILY PROTO-ONCOGENE PROTEIN NALO THERAPEUTICS (US) 2023-08-31 WO disclosed