SCHEMBL4668167

SCHEMBL4668167

N#CCc1c(-c2ccccc2)nc2ccccc2c1C(=O)NCCc1ccccc1

nearest known ligand 0.74

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.74
TP53 P04637 2/20 0.52
TACR3 P29371 6/20 0.47
CNR1 P21554 1/20 0.47
PTGFR P43088 1/20 0.46
MAPT P10636 1/20 0.46
RAB9A P51151 3/20 0.46
NPC1 O15118 2/20 0.46
TACR2 P21452 1/20 0.45
TAAR1 Q96RJ0 1/20 0.45
NAMPT P43490 1/20 0.44

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
SCHEMBL4668093 0.94 LMNA (0.65) LMNATP53TACR3CNR1RAB9A
SCHEMBL4665602 0.87 LMNA (0.57) LMNATP53TACR3TACR2NAMPT
SCHEMBL5140190 0.81 LMNA (0.76) LMNATP53TACR3PTGFRMAPT
SCHEMBL4668145 0.81 DHODH (0.60) LMNATACR3TACR2
SCHEMBL4667070 0.81 LMNA (0.74) LMNATP53TACR3PTGFRMAPT
SCHEMBL4665273 0.78 LMNA (0.67) LMNATP53TACR3PTGFRMAPT
SCHEMBL4666988 0.78 SMN1; SMN2 (0.51) LMNATP53TACR3MAPTTACR2
SCHEMBL4667071 0.78 LMNA (0.71) LMNATP53TACR3PTGFRMAPT
SCHEMBL5048810 0.78 LMNA (0.71) LMNATP53TACR3PTGFRMAPT
SCHEMBL4984967 0.78 LMNA (0.47) LMNATP53TACR3PTGFRTACR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1891012-A2 QUINOLINE DERIVATIVES AS NK3 ANATGONISTS AstraZeneca AB (SE) 2008-02-27 EP claimed
WO-2006130080-A2 QUINOLINE DERIVATIVES AS NK3 ANATGONISTS ASTRAZENECA AB (SE) 2006-12-07 WO claimed
EP-1891012-A2 QUINOLINE DERIVATIVES AS NK3 ANATGONISTS AstraZeneca AB (SE) 2008-02-27 EP disclosed
WO-2006130080-A2 QUINOLINE DERIVATIVES AS NK3 ANATGONISTS ASTRAZENECA AB (SE) 2006-12-07 WO disclosed