SCHEMBL20528735

SCHEMBL20528735

CC1CCc2c(N3CCC(O)CC3)c(F)cc3c2N1CC(C(=O)O)C3=O

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.50
PIM1 P11309 1/20 0.30
GSK3A P49840 1/20 0.30
GSK3B P49841 1/20 0.30
PIM3 Q86V86 1/20 0.30
CSNK1G1 Q9HCP0 1/20 0.30

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
SCHEMBL5012592 0.76 LMNA (0.52) LMNAPIM1GSK3AGSK3BPIM3
SCHEMBL5009339 0.76 LMNA (0.52) LMNAPIM1GSK3AGSK3BPIM3
SCHEMBL11081587 0.72 ALDH1A1 (0.35)
SCHEMBL20468385 0.71 KDM4E (0.52)
Nadifloxacin SCHEMBL3818938 0.67 LMNA (1.00) LMNA
Nadifloxacin SCHEMBL36593 0.67 LMNA (1.00) LMNA
Levonadifloxacin SCHEMBL3972618 0.66 LMNA (0.98) LMNA
SCHEMBL116307 0.65 POLB (0.30)
SCHEMBL12820265 0.65 ALDH1A1 (0.52) PIM1GSK3AGSK3BPIM3CSNK1G1
SCHEMBL4638291 0.65 LMNA (0.78) LMNA

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-3607084-A1 A METHOD FOR TESTING ANTIMICROBIAL SUSCEPTIBILITY The University Of Western Australia (AU) 2020-02-12 EP disclosed
WO-2018184073-A1 A METHOD FOR TESTING ANTIMICROBIAL SUSCEPTIBILITY THE UNIVERSITY OF WESTERN AUSTRALIA (AU) 2018-10-11 WO disclosed