SCHEMBL15566847

SCHEMBL15566847

CC(C)(C)OC(=O)N1CCC(Cn2ccc(F)cc2=O)CC1

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 10/20 0.48
KDM4E B2RXH2 2/20 0.47
PKM P14618 1/20 0.47
BRD3 Q15059 1/20 0.46
MAPT P10636 1/20 0.46
THRB P10828 1/20 0.46
DPP4 P27487 1/20 0.45
FPR2 P25090 1/20 0.45
BACE1 P56817 1/20 0.45

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
SCHEMBL22650836 0.87 BACE1 (0.48) GPR119KDM4EPKMMAPTTHRB
SCHEMBL31108104 0.87 FPR2 (0.51) GPR119KDM4EPKMMAPTTHRB
SCHEMBL27077258 0.84 KDM4E (0.52) GPR119KDM4EPKMBACE1
SCHEMBL31630958 0.82 KDM4E (0.48) GPR119KDM4EPKMMAPTTHRB
SCHEMBL31108111 0.81 IDO1 (0.46) GPR119KDM4EPKMMAPTTHRB
SCHEMBL28397415 0.80 KDM4E (0.52) GPR119KDM4EPKMMAPTTHRB
SCHEMBL28402009 0.78 BACE1 (0.51) GPR119KDM4EPKMMAPTFPR2
SCHEMBL4777921 0.78 KDM4E (0.54) GPR119KDM4EPKM
SCHEMBL31630884 0.76 KDM4E (0.48) GPR119KDM4EPKMMAPTTHRB
SCHEMBL29116026 0.76 GPR119 (0.52) GPR119KDM4EPKMBACE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9770452-B2 Quinoxaline derivatives as GPR6 modulators TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2017-09-26 US disclosed
US-20170035775-A1 QUINOXALINE DERIVATIVES AS GPR6 MODULATORS ENVOY THERAPEUTICS, INC. 2017-02-09 US disclosed
US-9487526-B2 Quinoxaline derivatives as GPR6 modulators TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-11-08 US disclosed
EP-2882722-B1 QUINOXALINE DERIVATIVES AS GPR6 MODULATORS TAKEDA PHARMACEUTICAL (JP) 2016-07-27 EP disclosed
US-20150232469-A1 QUINOXALINE DERIVATIVES AS GPR6 MODULATORS ENVOY THERAPEUTICS, INC. 2015-08-20 US disclosed
EP-2882722-A1 QUINOXALINE DERIVATIVES AS GPR6 MODULATORS Envoy Therapeutics Inc. (US) 2015-06-17 EP disclosed
WO-2014028479-A1 QUINOXALINE DERIVATIVES AS GPR6 MODULATORS ENVOY THERAPEUTICS, INC. (US) 2014-02-20 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150232469-A1 QUINOXALINE DERIVATIVES AS GPR6 MODULATORS GPR6, GRM6, GPR65 GPR119 25/4885KDM4E 3600/4885PKM 847/4885
US-20170035775-A1 QUINOXALINE DERIVATIVES AS GPR6 MODULATORS GPR6, GRM6, GPR65 GPR119 25/4885KDM4E 3600/4885PKM 847/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.