SCHEMBL19476946

SCHEMBL19476946

COc1ccc(N)cc1OC[C@H]1CCN(C)C1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ EHMT2 Q96KQ7 1/20 0.53
▸ DRD4 P21917 1/20 0.49
▸ CHRNB4 P30926 1/20 0.45
▸ CHRNA3 P32297 1/20 0.45
▸ HTR4 Q13639 2/20 0.45
▸ KDM4E B2RXH2 1/20 0.44
▸ GAA P10253 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ PDPK1 O15530 1/20 0.44
▸ PDE4B Q07343 3/20 0.44
▸ ACHE P22303 1/20 0.42
▸ EGFR P00533 5/20 0.42
▸ HTR2A P28223 1/20 0.42
▸ HTR7 P34969 1/20 0.42
▸ HTR6 P50406 1/20 0.42
▸ KIT P10721 1/20 0.42
▸ CHRM3 P20309 1/20 0.41

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
SCHEMBL19462030 1.00 EHMT2 (0.53) EHMT2DRD4CHRNB4CHRNA3HTR4
SCHEMBL19476947 1.00 EHMT2 (0.53) EHMT2DRD4CHRNB4CHRNA3HTR4
SCHEMBL21644468 0.94 PDPK1 (0.48) EHMT2DRD4CHRNB4CHRNA3HTR4
SCHEMBL19462027 0.92 CHRNB4 (0.49) EHMT2DRD4CHRNB4CHRNA3KDM4E
SCHEMBL6313905 0.89 KDM4E (0.51) EHMT2HTR4KDM4EGAAMAPT
SCHEMBL19462313 0.85 DRD4 (0.47) EHMT2DRD4CHRNB4CHRNA3HTR4
SCHEMBL5704546 0.85 GAA (0.51) DRD4KDM4EGAAMAPTPDE4B
SCHEMBL19462182 0.84 DRD4 (0.46) EHMT2DRD4CHRNB4CHRNA3HTR4
SCHEMBL19476950 0.83 EHMT2 (0.47) EHMT2DRD4CHRNB4CHRNA3PDPK1
SCHEMBL5704565 0.82 PDE4B (0.49) DRD4CHRNB4CHRNA3KDM4EGAA

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-2017181177-A1 AMINE-SUBSTITUTED ARYL OR HETEROARYL COMPOUNDS AS EHMT1 AND EHMT2 INHIBITORS Epizyme, Inc. (US) 2017-10-19 — — WO disclosed
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