SCHEMBL30367474

SCHEMBL30367474

CNc1ccnc(Nc2cccc(C(C)OCCN3CCCC3)c2)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.46
EHMT2 Q96KQ7 1/20 0.43
EHMT1 Q9H9B1 1/20 0.43
IGF1R P08069 2/20 0.43
EGFR P00533 3/20 0.43
AXL P30530 1/20 0.43
BACE1 P56817 1/20 0.43
INSR P06213 1/20 0.43
MET P08581 1/20 0.43
CDK2 P24941 1/20 0.43
KDR P35968 1/20 0.43
TEK Q02763 1/20 0.43
AIMP2 Q13155 1/20 0.42
FLT3 P36888 1/20 0.41
JAK2 O60674 3/20 0.40
JAK3 P52333 3/20 0.40
AURKA O14965 2/20 0.40
MAP3K5 Q99683 1/20 0.39
SRC P12931 3/20 0.39
EPHB4 P54760 1/20 0.39

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
SCHEMBL19461944 1.00 HRH3 (0.46) HRH3EHMT2EHMT1IGF1REGFR
SCHEMBL19476675 0.80 HRH3 (0.52) HRH3EHMT2EHMT1IGF1REGFR
SCHEMBL19476605 0.80 IGF1R (0.58) HRH3EHMT2EHMT1IGF1REGFR
SCHEMBL12278133 0.76 HRH3 (0.69) HRH3IGF1REGFRAXLBACE1
SCHEMBL19477506 0.73 EGFR (0.48) HRH3IGF1REGFRINSRMET
SCHEMBL19700632 0.73 SMN1; SMN2 (0.57) EGFRCDK2SYK
SCHEMBL19700631 0.73 SMN1; SMN2 (0.57) EGFRCDK2SYK
SCHEMBL30367379 0.73 EGFR (0.48) HRH3IGF1REGFRINSRMET
SCHEMBL21743299 0.73 SMN1; SMN2 (0.57) EGFRCDK2SYK
SCHEMBL19476671 0.73 EHMT2 (0.60) HRH3EHMT2EHMT1IGF1REGFR

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-3442947-B1 AMINE-SUBSTITUTED ARYL OR HETEROARYL COMPOUNDS AS EHMT1 AND EHMT2 INHIBITORS EPIZYME INC (US) 2023-06-07 EP disclosed