SCHEMBL5338430

SCHEMBL5338430

CC(C)(C)OC(=O)N1CC=C(c2cccc(NC(=O)Nc3csc(-c4ccncc4)n3)n2)CC1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CDK5 Q00535 4/20 0.51
▸ CDK5R1 Q15078 4/20 0.51
▸ GRM1 Q13255 9/20 0.49
▸ GRM5 P41594 8/20 0.46
▸ GPR119 Q8TDV5 2/20 0.44
▸ NAMPT P43490 1/20 0.43
▸ WNT3A P56704 1/20 0.43
▸ DYRK1A Q13627 1/20 0.42
▸ PDK4 Q16654 1/20 0.42
▸ DGAT2 Q96PD7 1/20 0.42

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
SCHEMBL5344399 0.84 CDK5 (0.63) CDK5CDK5R1WNT3ADYRK1A
SCHEMBL14558870 0.78 CDK5 (0.54) CDK5CDK5R1DYRK1A
SCHEMBL5661859 0.78 GRM1 (0.52) GRM1GRM5NAMPTPDK4DGAT2
SCHEMBL14558911 0.78 CDK5 (0.52) CDK5CDK5R1GPR119DYRK1A
SCHEMBL30308912 0.77 GRM1 (0.64) GRM1GRM5GPR119NAMPTPDK4
SCHEMBL23164876 0.77 GPR119 (0.55) GRM1GRM5GPR119NAMPTPDK4
SCHEMBL5341555 0.76 CDK5 (0.50) CDK5CDK5R1GPR119NAMPTWNT3A
SCHEMBL1863518 0.76 GRM1 (0.67) GRM1GRM5GPR119NAMPTPDK4
SCHEMBL14558453 0.75 CDK5 (0.49) CDK5CDK5R1GPR119NAMPTDYRK1A
SCHEMBL5344163 0.75 CDK5 (0.55) CDK5CDK5R1WNT3ADYRK1A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7196104-B2 Thiazolyl urea compounds and methods of uses AMGEN, INC. (US) 2007-03-27 — — US disclosed
US-7196104-B2 Thiazolyl urea compounds and methods of uses AMGEN, INC. (US) 2007-03-27 — — US disclosed
US-7196104-B2 Thiazolyl urea compounds and methods of uses AMGEN, INC. (US) 2007-03-27 — — US disclosed
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