SCHEMBL31442189

SCHEMBL31442189

C#Cc1cccc(NC(=O)C2CCCNC2)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.58
F10 P00742 1/20 0.54
ULK1 O75385 1/20 0.53
ALOX15 P16050 1/20 0.48
TNKS O95271 1/20 0.48
TNKS2 Q9H2K2 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
AURKA O14965 1/20 0.46
AURKB Q96GD4 1/20 0.46
KHK P50053 1/20 0.46
ALDH1A1 P00352 1/20 0.46
HTR6 P50406 3/20 0.46
HTR1A P08908 1/20 0.46
HTR1B P28222 1/20 0.46
HTR7 P34969 1/20 0.46
HTR2B P41595 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.45
TP53 P04637 1/20 0.45
F2R P25116 1/20 0.44
KCNK3 O14649 1/20 0.44

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
SCHEMBL15567075 0.82 RXFP1 (0.63) RXFP1NPSR1ALDH1A1SMN1; SMN2TP53
SCHEMBL259381 0.82 NPSR1 (0.72) F10ULK1ALOX15TNKSTNKS2
SCHEMBL2452221 0.82 F10 (0.56) F10ULK1ALOX15TNKSTNKS2
SCHEMBL2449231 0.82 F10 (0.56) F10ULK1ALOX15TNKSTNKS2
SCHEMBL21089893 0.82 ULK1 (0.50) RXFP1F10ULK1ALOX15AURKA
SCHEMBL1318173 0.81 HPGD (0.66) F10ULK1ALOX15TNKSTNKS2
SCHEMBL2446479 0.81 HPGD (0.66) F10ULK1ALOX15TNKSTNKS2
SCHEMBL1318166 0.81 HPGD (0.66) F10ULK1ALOX15TNKSTNKS2
Hydrochloric Acid SCHEMBL4033476 0.80 HPGD (0.64) F10ULK1ALOX15TNKSTNKS2
SCHEMBL24016844 0.79 RXFP1 (0.59) RXFP1F10ULK1ALOX15TNKS

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-119330934-A Degradation agent of targeted Smurf1 protein, preparation method and application 中国人民解放军军事科学院军事医学研究院 2025-01-21 CN disclosed