SCHEMBL29951828

SCHEMBL29951828

O=Cc1c(Cl)[nH]c2ccc(Br)cc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 2/20 0.46
PIM3 Q86V86 2/20 0.46
LMNA P02545 2/20 0.44
HPGD P15428 1/20 0.44
GSK3B P49841 3/20 0.42
CHEK1 O14757 1/20 0.41
AURKA O14965 1/20 0.41
DAPK3 O43293 1/20 0.41
JAK2 O60674 1/20 0.41
PRKD3 O94806 1/20 0.41
MAP4K4 O95819 1/20 0.41
PAK4 O96013 1/20 0.41
ABL1 P00519 1/20 0.41
NTRK1 P04629 1/20 0.41
CSF1R P07333 1/20 0.41
RET P07949 1/20 0.41
MET P08581 1/20 0.41
PDGFRB P09619 1/20 0.41
FGFR1 P11362 1/20 0.41
PDGFRA P16234 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
SCHEMBL16920112 1.00 PIM1 (0.46) PIM1PIM3LMNAHPGDGSK3B
SCHEMBL29952323 0.86 GSK3B (0.51) PIM1PIM3GSK3BJAK2GSK3A
SCHEMBL29363428 0.82 LMNA (0.51) LMNAHPGDMAPTCHUKALDH1A1
SCHEMBL22898794 0.82 LMNA (0.51) LMNAHPGDMAPTCHUKALDH1A1
SCHEMBL24522320 0.79 KDM4E (0.44) LMNAHPGDMAPTCHUKALDH1A1
SCHEMBL3198006 0.79 LMNA (0.51) PIM1PIM3LMNAHPGDGSK3B
SCHEMBL28460398 0.79 PIM1 (0.46) PIM1PIM3LMNAHPGDGSK3B
SCHEMBL24522294 0.79 KDM4E (0.46) LMNAHPGDMAPTHSD17B10ALDH1A1
SCHEMBL29363427 0.79 KDM4E (0.46) LMNAHPGDMAPTHSD17B10ALDH1A1
SCHEMBL29950892 0.79 CCNB2 (0.53) GSK3BCHEK1FLT3GSK3ACDK5

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
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed