SCHEMBL23819355

SCHEMBL23819355

CC(F)(F)OC1CC(C(=O)O)C1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BTK Q06187 1/20 0.34
OAT P04181 1/20 0.33
APLNR P35414 1/20 0.32
POLB P06746 1/20 0.32
LMNA P02545 1/20 0.31
GRM2 Q14416 1/20 0.31
CYP2C19 P33261 1/20 0.30
GABRR1 P24046 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
SCHEMBL11919497 0.83 BTK (0.40) BTKAPLNRPOLBLMNAGRM2
SCHEMBL16699710 0.83 OAT (0.35) OATAPLNRCYP2C19GABRR1
SCHEMBL16708925 0.83 OAT (0.35) OATAPLNRCYP2C19GABRR1
SCHEMBL16699712 0.83 OAT (0.35) OATAPLNRCYP2C19GABRR1
SCHEMBL301155 0.70
SCHEMBL12582055 0.70
SCHEMBL12449971 0.70
SCHEMBL16434120 0.69 HTT (0.33) OAT
SCHEMBL8970350 0.69 BTK (0.44) BTKAPLNRPOLBLMNAGRM2
SCHEMBL16276337 0.69 BTK (0.44) BTKAPLNRPOLBLMNAGRM2

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
WO-2021180774-A1 MODULATORS OF THE INTEGRATED STRESS RESPONSE PATHWAY EVOTEC INTERNATIONAL GMBH (DE) 2021-09-16 WO disclosed