SCHEMBL22235592

SCHEMBL22235592

O=C(O)N1CC2CN(C(=O)C(F)(F)F)CC2C1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 3/20 0.33
ESR1 P03372 3/20 0.32
ESR2 Q92731 3/20 0.32
KDM1A O60341 1/20 0.32
EPHX2 P34913 1/20 0.30
JAK2 O60674 1/20 0.30
JAK1 P23458 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
SCHEMBL22235591 1.00 EPHX1 (0.33) EPHX1ESR1ESR2KDM1AEPHX2
SCHEMBL17624414 0.81 HRH4 (0.36) EPHX1ESR1ESR2JAK2JAK1
SCHEMBL18498060 0.81 CHRNB2 (0.39)
SCHEMBL18498063 0.81 CHRNB2 (0.39)
SCHEMBL19504677 0.78 ATM (0.39) EPHX1ESR1ESR2JAK2JAK1
SCHEMBL22248806 0.77 CHRNA4 (0.55)
SCHEMBL28672272 0.77 CHRNA4 (0.55)
SCHEMBL3290798 0.76 PDK2 (0.36) EPHX1ESR1ESR2KDM1A
SCHEMBL13000721 0.75 ESR1 (0.33) EPHX1ESR1ESR2KDM1AJAK2
Hydrochloric Acid SCHEMBL22235812 0.75 CHRNA4 (0.53)

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-3911643-A1 ANTIMICROBIAL COMPOUNDS AND METHODS Curza Global LLC (US) 2021-11-24 EP disclosed
WO-2020150372-A1 ANTIMICROBIAL COMPOUNDS AND METHODS CURZA GLOBAL, LLC (US) 2020-07-23 WO disclosed