SCHEMBL9523405

SCHEMBL9523405

CC1Sc2c(C(=O)O)c(=O)c3cc(F)c(N4CCN(C)CC4)c(Cl)c3n21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 2/20 0.46
GSK3A P49840 2/20 0.46
GSK3B P49841 2/20 0.46
PIM3 Q86V86 2/20 0.46
CSNK1G1 Q9HCP0 1/20 0.46
KDM4E B2RXH2 7/20 0.46
ALDH1A1 P00352 5/20 0.46
HPGD P15428 4/20 0.46
HSD17B10 Q99714 3/20 0.46
ALB P02768 1/20 0.46
HRH3 Q9Y5N1 1/20 0.46
ADRA2B P18089 1/20 0.46
MAPK1 P28482 1/20 0.46
LMNA P02545 2/20 0.46
POLB P06746 2/20 0.45
TUBB4A P04350 1/20 0.45
TUBB P07437 1/20 0.45
TUBA3C P0DPH7 1/20 0.45
TUBA1B P68363 1/20 0.45
TUBA4A P68366 1/20 0.45

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
SCHEMBL9673522 0.91 PIM1 (0.55) PIM1GSK3AGSK3BPIM3CSNK1G1
SCHEMBL9523099 0.88 PIM1 (0.48) PIM1GSK3AGSK3BPIM3CSNK1G1
SCHEMBL9523505 0.88 PIM1 (0.46) PIM1GSK3AGSK3BPIM3CSNK1G1
SCHEMBL9523267 0.87 KMT2A (0.44) KDM4EALDH1A1HPGDHSD17B10ALB
SCHEMBL9522418 0.87 PIM1 (0.45) PIM1GSK3AGSK3BPIM3CSNK1G1
SCHEMBL9692559 0.85 PIM1 (0.65) PIM1GSK3AGSK3BPIM3CSNK1G1
SCHEMBL9694087 0.85 PIM1 (0.65) PIM1GSK3AGSK3BPIM3CSNK1G1
SCHEMBL9692577 0.85 PIM1 (0.65) PIM1GSK3AGSK3BPIM3CSNK1G1
SCHEMBL9523418 0.85 PIM1 (0.43) PIM1GSK3AGSK3BPIM3CSNK1G1
SCHEMBL9694446 0.83 PIM1 (0.50) PIM1GSK3AGSK3BPIM3CSNK1G1

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
EP-0249043-B1 QUINOLINECARBOXYLIC ACID DERIVATIVES NIPPON SHINYAKU COMPANY, LIMITED (JP) 1993-08-04 EP disclosed
US-4843070-A BACTERIDCIDES, FUNGICIDES NIPPON SHINYAKU CO., LTD. (JP) 1989-06-27 US disclosed