SCHEMBL8286390

SCHEMBL8286390

CCCCOC(=O)c1cc(C)c2c(=O)cc(Nc3ccccc3)n(-c3ccccc3)c2n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE11A Q9HCR9 1/20 0.40
CSF1R P07333 1/20 0.40
KDM4E B2RXH2 3/20 0.39
HTT P42858 1/20 0.39
MAPT P10636 3/20 0.38
LMNA P02545 2/20 0.38
TP53 P04637 2/20 0.37
HPGD P15428 2/20 0.37
HSD17B10 Q99714 1/20 0.37
SLC2A1 P11166 1/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
ALDH1A1 P00352 2/20 0.36
GAA P10253 1/20 0.36
TSHR P16473 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL8286372 0.92 CSF1R (0.47) PDE11ACSF1RKDM4EHTTMAPT
SCHEMBL8285228 0.86 PDE11A (0.42) PDE11ACSF1RKDM4EHTTMAPT
SCHEMBL8285167 0.85 PDE11A (0.41) PDE11ACSF1RKDM4EHTTMAPT
SCHEMBL8285174 0.84 PDE11A (0.43) PDE11ACSF1RKDM4EHTTMAPT
SCHEMBL8287518 0.84 PDE11A (0.44) PDE11ACSF1RKDM4EHTTMAPT
SCHEMBL5872175 0.83 PDE11A (0.47) PDE11ACSF1RKDM4EHTTMAPT
SCHEMBL8286396 0.83 PDE11A (0.44) PDE11ACSF1RKDM4EHTTHPGD
SCHEMBL5871541 0.82 PDE11A (0.46) PDE11ACSF1RKDM4EHTTMAPT
SCHEMBL8287397 0.81 PDE11A (0.46) PDE11ACSF1RKDM4EHTTMAPT
SCHEMBL8287393 0.81 PDE11A (0.46) PDE11AKDM4EHTTMAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005091857-A2 1,6-NAPHTHYRIDINE AND 1,8-NAPHTHYRIDINE DERIVATIVES AND THEIR USE TO TREAT DIABETES AND RELATED DISORDERS BAYER PHARMACEUTICALS CORPORATION (US) 2005-10-06 WO disclosed
WO-2003027112-A1 1, 8-NAPHTHYRIDINE DERIVATIVES AS ANTIDIABETICS BAYER PHARMACEUTICALS CORPORATION (US) 2003-04-03 WO disclosed