SCHEMBL3826388

SCHEMBL3826388

Cc1c(C#N)cnc(Cl)c1Cl

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CSNK1A1 P48729 1/20 0.41
CLK4 Q9HAZ1 1/20 0.41
ALDH1A1 P00352 4/20 0.41
NPSR1 Q6W5P4 3/20 0.41
TDP1 Q9NUW8 1/20 0.41
LRRK2 Q5S007 2/20 0.37
TSHR P16473 1/20 0.35
AR P10275 3/20 0.35
KDM4E B2RXH2 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
HPGD P15428 1/20 0.34
KMT2A Q03164 1/20 0.34
S1PR2 O95136 1/20 0.34
PIN1 Q13526 1/20 0.33
SRC P12931 2/20 0.33

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
SCHEMBL20302398 0.83 CSNK1A1 (0.41) CSNK1A1CLK4ALDH1A1NPSR1TDP1
SCHEMBL19741191 0.83 CSNK1A1 (0.41) CSNK1A1CLK4ALDH1A1NPSR1TDP1
SCHEMBL7815570 0.80 CSNK1A1 (0.45) CSNK1A1CLK4ALDH1A1NPSR1TDP1
SCHEMBL2981053 0.80 CSNK1A1 (0.39) CSNK1A1CLK4ALDH1A1NPSR1TDP1
SCHEMBL22890442 0.76 LRRK2 (0.36) CSNK1A1CLK4ALDH1A1NPSR1LRRK2
SCHEMBL30039332 0.75 CCR1 (0.41) ALDH1A1KDM4E
SCHEMBL22129513 0.75 CCR1 (0.41) ALDH1A1KDM4E
SCHEMBL22890472 0.74 LRRK2 (0.48) CSNK1A1CLK4LRRK2KDM4EKMT2A
SCHEMBL5149644 0.73 ALDH1A1 (0.55) ALDH1A1NPSR1TDP1TSHRKDM4E
SCHEMBL4476081 0.73 ADORA2A (0.50) CLK4ALDH1A1NPSR1TDP1LRRK2

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
WO-2016021742-A1 HETEROCYCLIC COMPOUNDS AS EP4 RECEPTOR ANTAGONISTS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-02-11 WO disclosed
CN-1863779-B indazole derivatives UBE INDUSTRIES 2010-05-05 CN disclosed
EP-1999110-B1 PROCESS FOR PREPARING l-HALO-2,7-NAPHTHYRIDINYL DERIVATIVES UCB PHARMA SA (BE) 2009-09-16 EP disclosed
US-20090221828-A1 Process for Preparing 1-Halo-2,7-Naphthyridinyl Derivatives UCB PHARMA, S.A. (BE) 2009-09-03 US disclosed
EP-1999110-A2 PROCESS FOR PREPARING l-HALO-2,7-NAPHTHYRIDINYL DERIVATIVES UCB Pharma, S.A. (BE) 2008-12-10 EP disclosed
WO-2007107345-A2 PROCESS FOR PREPARING l-HALO-2,7-NAPHTHYRIDINYL DERIVATIVES UCB PHARMA, S.A. (BE) 2007-09-27 WO disclosed
CN-1863779-A Novel indazole derivative UBE INDUSTRIES (JP) 2006-11-15 CN 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 (1 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-20090221828-A1 Process for Preparing 1-Halo-2,7-Naphthyridinyl Derivatives NPM1, XPO4, BRD7 CSNK1A1 395/4885CLK4 281/4885ALDH1A1 2507/4885

“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.