SCHEMBL770057

SCHEMBL770057

CC1(C)OB(c2cnc(Cl)c(C(S(=O)(=O)c3ccc(F)cc3)S(=O)(=O)c3ccc(F)cc3)c2)OC1(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPL P06858 1/20 0.40
LIPG Q9Y5X9 1/20 0.40
ALPL P05186 1/20 0.37
AAK1 Q2M2I8 1/20 0.35
PSEN1 P49768 3/20 0.35
PSEN2 P49810 3/20 0.35
APH1B Q8WW43 3/20 0.35
NCSTN Q92542 3/20 0.35
APH1A Q96BI3 3/20 0.35
PSENEN Q9NZ42 3/20 0.35
CA1 P00915 5/20 0.33
CA2 P00918 5/20 0.33
CA9 Q16790 5/20 0.33
CXCR2 P25025 1/20 0.32
IDO1 P14902 1/20 0.32
TDO2 P48775 1/20 0.32
PDGFRB P09619 3/20 0.32
KDR P35968 3/20 0.32
PIK3CD O00329 1/20 0.32
CA12 O43570 1/20 0.32

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
SCHEMBL29556220 0.78 PIK3CD (0.53) PIK3CDPIK3CAMTOR
SCHEMBL770195 0.78 LPL (0.40) LPLLIPGALPLPSEN1PSEN2
SCHEMBL409468 0.78 PIK3CD (0.53) PIK3CDPIK3CAMTOR
SCHEMBL12460738 0.71 LPL (0.41) LPLLIPGALPLAAK1PDGFRB
SCHEMBL29712238 0.71 LPL (0.41) LPLLIPGALPLAAK1PDGFRB
SCHEMBL12276481 0.70 PIK3CD (0.57) ALPLPIK3CDPIK3CAMTOR
SCHEMBL29556116 0.70 PIK3CD (0.57) ALPLPIK3CDPIK3CAMTOR
SCHEMBL15555994 0.68 DGAT1 (0.37) LPLLIPGALPLAAK1PDGFRB
SCHEMBL15559069 0.67 ALPL (0.52) ALPLPIK3CDPIK3CAMTOR
SCHEMBL11910717 0.66 DGAT1 (0.36) LPLLIPGALPLAAK1PDGFRB

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-8729074-B2 Inhibitors of PI3 kinase AMGEN INC. (US) 2014-05-20 US disclosed
US-8729074-B2 Inhibitors of PI3 kinase AMGEN INC. (US) 2014-05-20 US disclosed
US-20120071474-A1 INHIBITORS OF PI3 KINASE AMGEN INC. (US) 2012-03-22 US disclosed
US-20120071474-A1 INHIBITORS OF PI3 KINASE AMGEN INC. (US) 2012-03-22 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-20120071474-A1 INHIBITORS OF PI3 KINASE PIK3CA, PIK3CD, PIK3CG LPL 2119/4885LIPG 1307/4885ALPL 2413/4885

“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.