SCHEMBL15566786

SCHEMBL15566786

Clc1nc2ccnc(Cl)c2nc1Cl

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.44
LMNA P02545 1/20 0.35
CYP3A4 P08684 1/20 0.35
MAPT P10636 1/20 0.35
APEX1 P27695 1/20 0.35
MAPK1 P28482 1/20 0.35
PMP22 Q01453 1/20 0.35
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32
KDM4E B2RXH2 1/20 0.30
PKM P14618 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
SCHEMBL15228750 0.83 PIM1 (0.36) LMNACYP3A4MAPTAPEX1MAPK1
SCHEMBL17268448 0.80 MAPT (0.42) TDP1LMNACYP3A4MAPTAPEX1
SCHEMBL16818170 0.80 TDP1 (0.39) TDP1MAPTKMT2A
SCHEMBL15900397 0.76 ALDH1A1 (0.39) TDP1LMNACYP3A4MAPTAPEX1
SCHEMBL17844934 0.76 ALDH1A1 (0.39) TDP1LMNACYP3A4MAPTAPEX1
SCHEMBL15228714 0.74 MAPT (0.31) LMNAMAPTMEN1KMT2AKDM4E
SCHEMBL29524731 0.73 MAPT (0.40) TDP1LMNACYP3A4MAPTAPEX1
SCHEMBL17844888 0.73 MAPT (0.40) TDP1LMNACYP3A4MAPTAPEX1
SCHEMBL15900423 0.73 LMNA (0.31) TDP1LMNACYP3A4MAPTAPEX1
SCHEMBL17954350 0.73 ADRA2A (0.38) LMNACYP3A4MAPTAPEX1MAPK1

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 TDP1 3457/4885LMNA 4739/4885CYP3A4 1808/4885
US-20170035775-A1 QUINOXALINE DERIVATIVES AS GPR6 MODULATORS GPR6, GRM6, GPR65 TDP1 3457/4885LMNA 4739/4885CYP3A4 1808/4885

“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.