SCHEMBL12975554

SCHEMBL12975554

CC(C)(C)OC(=O)N1CCOc2ccc(/C=C3\SC(=O)NC3=O)cc21

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 5/20 0.54
GPR119 Q8TDV5 4/20 0.47
PIK3CA P42336 1/20 0.45
PIK3CG P48736 1/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
PIM1 P11309 6/20 0.44
PIM2 Q9P1W9 5/20 0.44
PIM3 Q86V86 3/20 0.44
AKR1B1 P15121 2/20 0.44
CDC7 O00311 1/20 0.43
DAPK3 O43293 1/20 0.43
DYRK3 O43781 1/20 0.43
MAP4K4 O95819 1/20 0.43
PHKG2 P15735 1/20 0.43
RPS6KB1 P23443 1/20 0.43
CSNK1D P48730 1/20 0.43
CLK2 P49760 1/20 0.43
GSK3A P49840 1/20 0.43
NEK4 P51957 1/20 0.43

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
SCHEMBL2883153 1.00 GSK3B (0.54) GSK3BGPR119PIK3CAPIK3CGNPC1
SCHEMBL2877773 0.85 GSK3B (0.60) GSK3BPIK3CAPIK3CGNPC1RAB9A
SCHEMBL12975564 0.85 GSK3B (0.60) GSK3BPIK3CAPIK3CGNPC1RAB9A
SCHEMBL2878054 0.81 EGFR (0.45)
SCHEMBL30418523 0.81 EGFR (0.45)
SCHEMBL2884894 0.80 GSK3B (0.56) GSK3BPIK3CAPIK3CGNPC1RAB9A
SCHEMBL12975565 0.80 GSK3B (0.56) GSK3BPIK3CAPIK3CGNPC1RAB9A
SCHEMBL6262517 0.79 CSNK2A2 (0.57) PIK3CGNPC1RAB9ACSNK2A1DYRK1A
SCHEMBL6262522 0.79 CSNK2A2 (0.57) PIK3CGNPC1RAB9ACSNK2A1DYRK1A
SCHEMBL12975573 0.78 GSK3B (0.46) GSK3BGPR119PIK3CAPIK3CGNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7846925-B2 Azolidinone-vinyl fused-benzene derivatives MERCK SERONO SA (CH) 2010-12-07 US disclosed
US-7846925-B2 Azolidinone-vinyl fused-benzene derivatives MERCK SERONO SA (CH) 2010-12-07 US disclosed
US-20090306069-A1 AZOLIDINONE-VINYL FUSED-BENZENE DERIVATIVES LABORATOIRES SERONO S.A. (CH) 2009-12-10 US disclosed
US-20090306069-A1 AZOLIDINONE-VINYL FUSED-BENZENE DERIVATIVES LABORATOIRES SERONO S.A. (CH) 2009-12-10 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090306069-A1 AZOLIDINONE-VINYL FUSED-BENZENE DERIVATIVES ZAP70, BRCA1, ZYX GSK3B 2843/4885GPR119 710/4885PIK3CA 619/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.