SCHEMBL23980785

SCHEMBL23980785

COC(=O)c1ccc2nc(CCl)n(C[C@H](C)OC)c2n1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 1/20 0.36
PPARG P37231 2/20 0.34
PDE10A Q9Y233 1/20 0.33
ADORA2A P29274 1/20 0.33
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
LMNA P02545 2/20 0.32
DRD2 P14416 2/20 0.31
TBXA2R P21731 2/20 0.31
IAPP P10997 1/20 0.31
TP53 P04637 3/20 0.31
NPC1 O15118 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
OGA O60502 1/20 0.31

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
SCHEMBL31143242 0.85 MAPT (0.38) PTGER4PPARGPDE10AKDM4EALDH1A1
SCHEMBL31143304 0.85 MAPT (0.38) PTGER4PPARGPDE10AKDM4EALDH1A1
SCHEMBL30798199 0.81 TP53 (0.44) PTGER4ADORA2AKDM4EALDH1A1MAPT
SCHEMBL25544377 0.79 PPARG (0.45) PTGER4PPARGKDM4EALDH1A1IAPP
SCHEMBL31202954 0.78 ACSS2 (0.46) KDM4EALDH1A1MAPTLMNADRD2
SCHEMBL26237230 0.78 ACSS2 (0.46) KDM4EALDH1A1MAPTLMNADRD2
SCHEMBL20288189 0.76 GLP1R (0.42) KDM4EALDH1A1MAPTCYP1A2CYP3A4
SCHEMBL29480799 0.76 GLP1R (0.42) KDM4EALDH1A1MAPTCYP1A2CYP3A4
SCHEMBL20280071 0.76 GLP1R (0.42) KDM4EALDH1A1MAPTCYP1A2CYP3A4
SCHEMBL29480797 0.76 GLP1R (0.42) KDM4EALDH1A1MAPTCYP1A2CYP3A4

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-2021219019-A1 HETEROCYCLIC GLP-1 AGONISTS GASHERBRUM BIO, INC. (US) 2021-11-04 WO disclosed