SCHEMBL23019809

SCHEMBL23019809

CC1CN(c2ccc(F)cn2)CC(C)O1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.51
KDM4E B2RXH2 3/20 0.44
HTT P42858 1/20 0.44
GRM1 Q13255 2/20 0.44
AOC3 Q16853 3/20 0.44
CHIA Q9BZP6 1/20 0.44
TLR9 Q9NR96 1/20 0.42
TLR8 Q9NR97 1/20 0.42
TLR7 Q9NYK1 1/20 0.42
GPR119 Q8TDV5 1/20 0.42
ALDH1A1 P00352 2/20 0.41
MAPT P10636 1/20 0.41
RAB9A P51151 1/20 0.41
GAA P10253 1/20 0.41
GAK O14976 1/20 0.40
ADRA1A P35348 1/20 0.40
PGR P06401 1/20 0.40
GPR183 P32249 1/20 0.40
SMO Q99835 1/20 0.40
HCRTR1 O43613 1/20 0.40

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
SCHEMBL20004006 1.00 KMT2A (0.51) KMT2AKDM4EHTTGRM1AOC3
SCHEMBL26048823 0.84 GRM1 (0.47) GRM1CHIAGPR119MAPTHCRTR1
SCHEMBL18436130 0.81 KMT2A (0.53) KMT2AKDM4EAOC3TLR9TLR8
SCHEMBL10034110 0.81 KMT2A (0.53) KMT2AKDM4EAOC3TLR9TLR8
SCHEMBL15743968 0.81 KMT2A (0.53) KMT2AKDM4EAOC3TLR9TLR8
SCHEMBL24018507 0.81 KMT2A (0.53) KMT2AKDM4EAOC3TLR9TLR8
SCHEMBL31182223 0.81 KMT2A (0.53) KMT2AKDM4EAOC3TLR9TLR8
SCHEMBL13105214 0.81 KMT2A (0.49) KMT2AKDM4EAOC3TLR9TLR8
SCHEMBL17803130 0.80 KMT2A (0.51) KMT2AKDM4EHTTAOC3TLR9
SCHEMBL17128421 0.80 KMT2A (0.51) KMT2AKDM4EHTTAOC3TLR9

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3943490-A1 1-CYANO-PYRROLIDINE COMPOUNDS AS USP30 INHIBITORS Mission Therapeutics Limited (GB) 2022-01-26 EP disclosed
EP-3277677-B9 1-CYANO-PYRROLIDINE COMPOUNDS AS USP30 INHIBITORS MISSION THERAPEUTICS LTD (GB) 2021-07-14 EP disclosed
EP-3842427-A1 1-CYANO-PYRROLIDINE COMPOUNDS AS USP30 INHIBITORS Mission Therapeutics Limited (GB) 2021-06-30 EP disclosed
EP-3277677-B1 1-CYANO-PYRROLIDINE COMPOUNDS AS USP30 INHIBITORS MISSION THERAPEUTICS LTD (GB) 2021-02-24 EP disclosed