SCHEMBL15565872

SCHEMBL15565872

Fc1ccc2nc(NC3CC3)c(Cl)nc2c1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPR6 P46095 12/20 0.52
JAK2 O60674 3/20 0.47
KMT2A Q03164 1/20 0.42
RXFP1 Q9HBX9 1/20 0.41
CYP2D6 P10635 5/20 0.41
KDM4E B2RXH2 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
SCHEMBL15565237 0.84 KMT2A (0.43) GPR6JAK2KMT2A
SCHEMBL15566121 0.82 IRAK4 (0.47) GPR6KMT2ARXFP1KDM4E
SCHEMBL15567569 0.80 TDP1 (0.50) GPR6KMT2ARXFP1CYP2D6KDM4E
SCHEMBL15566254 0.78 GPR6 (0.54) GPR6
SCHEMBL10846446 0.78 RXFP1 (0.45) GPR6KMT2ARXFP1KDM4E
SCHEMBL31399981 0.76 KDM4E (0.57) KMT2ARXFP1KDM4E
SCHEMBL118875 0.76 KDM4E (0.57) KMT2ARXFP1KDM4E
SCHEMBL17007727 0.75 GPR6 (0.47) GPR6KMT2A
SCHEMBL15566859 0.74 GPR6 (0.62) GPR6CYP2D6
SCHEMBL15566370 0.74 GPR6 (0.49) GPR6CYP2D6

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 GPR6 1/4885JAK2 3020/4885KMT2A 1814/4885
US-20170035775-A1 QUINOXALINE DERIVATIVES AS GPR6 MODULATORS GPR6, GRM6, GPR65 GPR6 1/4885JAK2 3020/4885KMT2A 1814/4885

“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.