SCHEMBL7991828

SCHEMBL7991828

Oc1cccn2cc(C(F)(F)F)nc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.40
JAK3 P52333 1/20 0.40
PTK2 Q05397 1/20 0.40
LMNA P02545 2/20 0.39
POLB P06746 1/20 0.39
PIK3R1 P27986 1/20 0.38
PIK3CA P42336 1/20 0.38
HRH3 Q9Y5N1 1/20 0.36
SCN5A Q14524 1/20 0.34
HDAC4 P56524 2/20 0.34
KDM4E B2RXH2 3/20 0.33
ALDH1A1 P00352 3/20 0.33
GLA P06280 1/20 0.33
GAA P10253 1/20 0.33
MPI P34949 1/20 0.33
NPC1 O15118 2/20 0.33
TP53 P04637 2/20 0.33
RAB9A P51151 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
HSD17B10 Q99714 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
SCHEMBL24424563 0.81 SCN5A (0.35) POLBPIK3R1PIK3CASCN5AHDAC4
SCHEMBL1892615 0.81 USP7 (0.38) LMNAPIK3R1PIK3CASCN5AHDAC4
SCHEMBL2171161 0.79 DHFR (0.44) JAK2POLBPIK3R1PIK3CASCN5A
SCHEMBL20713184 0.79 NPC1 (0.53) LMNAPOLBKDM4EALDH1A1GAA
SCHEMBL2317617 0.79 ALDH1A3 (0.33) PIK3R1PIK3CASCN5AHDAC4KDM4E
SCHEMBL24857504 0.79 PIK3R1 (0.36) PIK3R1PIK3CASCN5AHDAC4KDM4E
SCHEMBL3265976 0.78 DHODH (0.57) LMNAPOLBHDAC4KDM4EHSD17B10
SCHEMBL24857447 0.77 CA2 (0.34) PIK3R1PIK3CASCN5AHDAC4KDM4E
SCHEMBL2173235 0.77 MAT2A (0.38) POLBPIK3R1PIK3CASCN5AHDAC4
SCHEMBL4970466 0.76 SCN5A (0.32) PIK3R1PIK3CASCN5AHDAC4KDM4E

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
WO-2001096335-A1 IMIDAZO[1,2-A]PYRIDINE ETHER COMPOUNDS AS ION CHANNEL MODULATORS CARDIOME PHARMA CORP. (CA) 2001-12-20 WO disclosed