SCHEMBL28043696

SCHEMBL28043696

Nc1ccccc1-n1ccc2ccncc2c1=O

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 12/20 0.43
KDM4E B2RXH2 1/20 0.42
POLB P06746 1/20 0.42
HTT P42858 1/20 0.42
RAD52 P43351 1/20 0.42
MAPK14 Q16539 1/20 0.41
LMNA P02545 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
STING1 Q86WV6 1/20 0.38
CDC7 O00311 1/20 0.38
CDK2 P24941 1/20 0.38
HTR1A P08908 2/20 0.36
HTR2A P28223 2/20 0.36
IDO1 P14902 1/20 0.36
DRD2 P14416 1/20 0.36

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
SCHEMBL30367319 0.75 MAPT (0.51) MAPTKDM4E
SCHEMBL31082541 0.74 MAPK1 (0.42) MAPTKDM4EPOLBHTTLMNA
SCHEMBL28116240 0.71 CYP19A1 (0.44) MAPTKDM4ELMNA
SCHEMBL4249660 0.70 DHPS (0.57) KDM4EHTTLMNASTING1HTR1A
SCHEMBL4383990 0.69 CYP1A2 (0.39) MAPTKDM4EPOLBHTTRAD52
SCHEMBL28001902 0.68 STING1 (0.38) MAPTKDM4EPOLBHTTRAD52
SCHEMBL29720794 0.68 BRD9 (0.44) MAPTSTING1HTR1AHTR2ADRD2
SCHEMBL15344922 0.68 BRD9 (0.44) MAPTSTING1HTR1AHTR2ADRD2
SCHEMBL30171226 0.68 HTR2A (0.38) MAPTSTING1HTR1AHTR2AIDO1
SCHEMBL28948256 0.68 HTR2A (0.38) MAPTSTING1HTR1AHTR2AIDO1

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
CN-105153156-A Preparation method for 4-phenyl-2,7-naphthyridine-1(2H)-ketone XU FENG 2015-12-16 CN disclosed