SCHEMBL9692671

SCHEMBL9692671

CCOC(=O)c1c2n(c3c(Cl)c(N4CC[C@H](NC(=O)OC(C)(C)C)C4)c(F)cc3c1=O)C(C)S2

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 2/20 0.36
PIM3 Q86V86 2/20 0.36
GSK3A P49840 1/20 0.36
GSK3B P49841 1/20 0.36
CSNK1G1 Q9HCP0 1/20 0.36
JAK3 P52333 1/20 0.35
BTK Q06187 1/20 0.35
F10 P00742 1/20 0.35
PIM2 Q9P1W9 1/20 0.35
ALDH1A1 P00352 1/20 0.34
POLB P06746 1/20 0.34
CHRM2 P08172 1/20 0.34
CHRM1 P11229 1/20 0.34
OPRM1 P35372 1/20 0.34
OPRD1 P41143 1/20 0.34
SUV39H2 Q9H5I1 7/20 0.34
LMNA P02545 1/20 0.34
KDM4D Q6B0I6 1/20 0.34
BRD4 O60885 2/20 0.33
TOP1 P11387 1/20 0.33

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
SCHEMBL9694518 1.00 PIM1 (0.36) PIM1PIM3GSK3AGSK3BCSNK1G1
SCHEMBL9692687 1.00 PIM1 (0.36) PIM1PIM3GSK3AGSK3BCSNK1G1
SCHEMBL9693751 0.94 PIM1 (0.42) PIM1PIM3GSK3AGSK3BCSNK1G1
SCHEMBL9693745 0.94 PIM1 (0.42) PIM1PIM3GSK3AGSK3BCSNK1G1
SCHEMBL9694322 0.94 PIM1 (0.42) PIM1PIM3GSK3AGSK3BCSNK1G1
SCHEMBL9694038 0.90 PIM1 (0.45) PIM1PIM3GSK3AGSK3BCSNK1G1
SCHEMBL9694033 0.90 PIM1 (0.45) PIM1PIM3GSK3AGSK3BCSNK1G1
SCHEMBL9692706 0.90 PIM1 (0.37) PIM1PIM3GSK3AGSK3BCSNK1G1
SCHEMBL9692712 0.90 PIM1 (0.37) PIM1PIM3GSK3AGSK3BCSNK1G1
SCHEMBL9693682 0.90 PIM1 (0.37) PIM1PIM3GSK3AGSK3BCSNK1G1

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
US-5126337-A Wide-spectrum bactericides HOKURIKU PHARMACEUTICAL CO., LTD. (JP) 1992-06-30 US disclosed
EP-0465716-A1 Optically active thiazetoquino-line-3-carboxylic acid compound, method for preparation thereof, and a pharmaceutical composition comprising the same HOKURIKU PHARMACEUTICAL CO., LTD. (JP) 1992-01-15 EP disclosed