Sugi Predict

Sugi Predict / Compounds / Morpholine

Morpholine

Morpholine

SCHEMBL5822017

C1COCCN1.O=C(c1cccc2[nH]c(-c3n[nH]c4ncc(-c5cncc6ccccc56)cc34)nc12)N1CCOCC1

nearest known ligand 0.51

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CDK1 P06493 12/20 0.51
▸ KDR P35968 9/20 0.51
▸ RET P07949 6/20 0.50
▸ ERBB2 P04626 4/20 0.45
▸ CLK2 P49760 2/20 0.41
▸ CLK3 P49761 2/20 0.41
▸ DYRK1A Q13627 2/20 0.41
▸ GRM4 Q14833 2/20 0.41
▸ FGFR1 P11362 1/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40

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
SCHEMBL4039574 0.96 CDK1 (0.54) CDK1KDRRETERBB2CLK2
Pyrrolidine SCHEMBL5820833 0.91 CDK1 (0.53) CDK1KDRRETERBB2CLK2
Piperidine SCHEMBL5823118 0.90 CDK1 (0.52) CDK1KDRRETERBB2CLK2
SCHEMBL4035045 0.90 CDK1 (0.57) CDK1KDRRETERBB2CLK2
SCHEMBL4033921 0.89 CDK1 (0.56) CDK1KDRRETERBB2CLK2
SCHEMBL13797810 0.88 CDK1 (0.56) CDK1KDRRETERBB2CLK2
SCHEMBL19497652 0.83 WNT1 (0.46) RETCLK2CLK3DYRK1AGRM4
SCHEMBL4033912 0.82 CDK1 (0.72) CDK1KDRRETERBB2CLK2
SCHEMBL12370327 0.81 CLK2 (0.56) CLK2CLK3DYRK1A
SCHEMBL4035660 0.81 CDK1 (0.53) CDK1KDRRETERBB2FGFR1

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-2006130673-A1 3-BENZOIMIDAZOLYL-PYRAZOLOPYRIDINES USEFUL IN TREATING KINASE DISORDERS JANSSEN PHARMACEUTICA, N.V. (BE) 2006-12-07 — — WO disclosed