SCHEMBL7489689

SCHEMBL7489689

COc1ccc2c(c1)nc(C(F)(F)F)c1nc(-c3ccccc3)n(CCC3CCNCC3)c12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACP1 P24666 2/20 0.40
NPY1R P25929 1/20 0.37
PDE6D O43924 1/20 0.36
ALDH1A1 P00352 2/20 0.36
CLK4 Q9HAZ1 2/20 0.36
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
ALOX15 P16050 1/20 0.36
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36
HIF1A Q16665 1/20 0.36
HSD17B10 Q99714 1/20 0.36
AVPR2 P30518 3/20 0.35
AVPR1A P37288 3/20 0.35
PDE10A Q9Y233 1/20 0.35
KDM4E B2RXH2 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
FGFR1 P11362 2/20 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
SCHEMBL7493968 0.94 ACP1 (0.40) ACP1NPY1RPDE6DALDH1A1CLK4
SCHEMBL6838389 0.91 ACP1 (0.46) ACP1NPY1RPDE6DALDH1A1LMNA
SCHEMBL6838553 0.90 ACP1 (0.38) ACP1NPY1RALDH1A1LMNATP53
SCHEMBL6833817 0.90 KHK (0.38) NPY1RPDE6DAVPR2AVPR1AMERTK
SCHEMBL6838690 0.89 CYP1A2 (0.36) ACP1ALDH1A1CLK4LMNATP53
SCHEMBL7493132 0.89 ACP1 (0.38) ACP1NPY1RPDE6DAVPR2AVPR1A
SCHEMBL6838705 0.88 NPY1R (0.40) ACP1NPY1RTP53CYP1A2CYP3A4
SCHEMBL6838517 0.88 NPY1R (0.38) ACP1NPY1RALDH1A1CLK4LMNA
SCHEMBL6833986 0.88 AVPR2 (0.35) ACP1NPY1RPDE6DAVPR2AVPR1A
SCHEMBL6833713 0.87 NPY1R (0.39) ACP1NPY1RPDE6DCYP1A2AVPR2

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
EP-1256582-A1 1H-IMIDAZOPYRIDINE DERIVATIVES HOKURIKU SEIYAKU CO., LTD. (JP) 2002-11-13 EP disclosed