SCHEMBL19203779

SCHEMBL19203779

CC(C)(C)c1noc(CO)n1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 2/20 0.40
PIK3CG P48736 2/20 0.35
AOC3 Q16853 2/20 0.31
NPC1 O15118 1/20 0.30
HTT P42858 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL22515570 0.83 NOTUM (0.38) NOTUMPIK3CG
SCHEMBL8738333 0.80 PIK3CG (0.36) PIK3CGNPC1HTTRAB9ASMN1; SMN2
SCHEMBL15945546 0.80 NPC1 (0.45) PIK3CGNPC1HTTRAB9ASMN1; SMN2
SCHEMBL21709605 0.78 PIK3CG (0.39) NOTUMPIK3CGAOC3NPC1HTT
SCHEMBL506677 0.78 PIK3CG (0.35) PIK3CGNPC1HTTRAB9ASMN1; SMN2
SCHEMBL10228806 0.78 PIK3CG (0.35) PIK3CGNPC1HTTRAB9ASMN1; SMN2
SCHEMBL24259026 0.77 SIRT2 (0.39) PIK3CGNPC1RAB9ASMN1; SMN2
SCHEMBL18997069 0.77 PIK3CG (0.34) PIK3CGNPC1RAB9ASMN1; SMN2
SCHEMBL16544514 0.77 SMN1; SMN2 (0.41) PIK3CGNPC1HTTRAB9ASMN1; SMN2
SCHEMBL1785672 0.75 PIK3CG (0.37) PIK3CGAOC3NPC1RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200048288-A1 PHOSPHOROUS DERIVATIVES AS KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2020-02-13 US disclosed
US-20170218000-A1 PHOSPHOROUS DERIVATIVES AS KINASE INHIBITORS ARIAD PHARMACEUTICALS, INC. 2017-08-03 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 (2 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-20170218000-A1 PHOSPHOROUS DERIVATIVES AS KINASE INHIBITORS MAP3K6, PIK3CA, MAP3K20 NOTUM 3121/4885PIK3CG 55/4885AOC3 4818/4885
US-20200048288-A1 PHOSPHOROUS DERIVATIVES AS KINASE INHIBITORS MAP3K6, PIK3CA, MAP3K20 NOTUM 3121/4885PIK3CG 55/4885AOC3 4818/4885

“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.