SCHEMBL19083748

SCHEMBL19083748

CC(C)C(=O)N1CC[C@H](C)[C@H]1C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.40
ACE P12821 6/20 0.35
REN P00797 4/20 0.35
KDM4E B2RXH2 1/20 0.35
F2 P00734 1/20 0.35
LMNA P02545 1/20 0.35
LTA4H P09960 1/20 0.35
MAPT P10636 1/20 0.35
PEPD P12955 1/20 0.35
ALOX15 P16050 1/20 0.35
PTGS1 P23219 1/20 0.35
HTR2A P28223 1/20 0.35
PTGS2 P35354 1/20 0.35
HRH1 P35367 1/20 0.35
THPO P40225 1/20 0.35
PMP22 Q01453 1/20 0.35
HSD17B10 Q99714 1/20 0.35
ACE2 Q9BYF1 1/20 0.35
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34

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
SCHEMBL4251895 0.83 PIK3CD (0.41) PIK3CDACERENKDM4EF2
SCHEMBL4254321 0.83 PIK3CD (0.41) PIK3CDACERENKDM4EF2
SCHEMBL4250867 0.83 PIK3CD (0.41) PIK3CDACERENKDM4EF2
SCHEMBL4258782 0.83 PIK3CD (0.41) PIK3CDACERENKDM4EF2
SCHEMBL4250866 0.83 PIK3CD (0.41) PIK3CDACERENKDM4EF2
SCHEMBL4254324 0.83 PIK3CD (0.41) PIK3CDACERENKDM4EF2
SCHEMBL1025789 0.80 ATM (0.31) MAPT
SCHEMBL1081071 0.80 ATM (0.31) MAPT
SCHEMBL3235500 0.80 ACE (0.37) PIK3CDACERENKDM4EF2
SCHEMBL11046748 0.80 ACE (0.37) PIK3CDACERENKDM4EF2

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-10005724-B2 Therapeutic compounds and methods of use thereof GENENTECH, INC. (US) 2018-06-26 US disclosed
US-20170190662-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2017-07-06 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-20170190662-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF RDX, C1R, MTX1 PIK3CD 4518/4885ACE 1083/4885REN 17/4885
US-10005724-B2 Therapeutic compounds and methods of use thereof RDX, C1R, MTX1 PIK3CD 4518/4885ACE 1083/4885REN 17/4885

“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.