SCHEMBL17176115

SCHEMBL17176115

CC(C)[C@@H](O)C(=O)N1CCC(C)(C)C1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PIK3R1 P27986 3/20 0.38
PIK3CA P42336 3/20 0.38
SPR P35270 1/20 0.36
DPP4 P27487 1/20 0.34
DPP7 Q9UHL4 1/20 0.34
CCR1 P32246 11/20 0.33
ROCK2 O75116 1/20 0.33
CYP3A4 P08684 1/20 0.33
LIPE Q05469 1/20 0.33
RET P07949 1/20 0.32
TSHR P16473 1/20 0.32
NFKB1 P19838 1/20 0.32
CYP2C19 P33261 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
SCHEMBL17176168 1.00 PIK3R1 (0.38) PIK3R1PIK3CASPRDPP4DPP7
SCHEMBL17176110 0.84 SPR (0.37) PIK3R1PIK3CASPRDPP4DPP7
SCHEMBL17176147 0.84 SPR (0.37) PIK3R1PIK3CASPRDPP4DPP7
SCHEMBL17173001 0.84 PIK3R1 (0.34) PIK3R1PIK3CADPP4DPP7CCR1
SCHEMBL17172999 0.84 PIK3R1 (0.34) PIK3R1PIK3CADPP4DPP7CCR1
SCHEMBL17177185 0.82 CHRNB2 (0.39) PIK3R1PIK3CASPRDPP4DPP7
SCHEMBL17176073 0.79 DPP4 (0.42) PIK3R1PIK3CADPP4DPP7
SCHEMBL17176096 0.79 DPP4 (0.42) PIK3R1PIK3CADPP4DPP7
SCHEMBL18390373 0.79 USP2 (0.40) PIK3R1PIK3CACYP3A4RETTSHR
SCHEMBL17177220 0.78 DPP4 (0.41) PIK3R1PIK3CASPRDPP4DPP7

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-9260439-B2 Dihydropyrrolopyrimidine derivatives PFIZER INC. (US) 2016-02-16 US disclosed
US-20150291604-A1 DIHYDROPYRROLOPYRIMIDINE DERIVATIVES PFIZER (US) 2015-10-15 US disclosed
WO-2015155624-A1 DIHYDROPYRROLOPYRIMIDINE DERIVATIVES PFIZER INC. (US) 2015-10-15 WO 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-20150291604-A1 DIHYDROPYRROLOPYRIMIDINE DERIVATIVES DPYD, TPD52L2, DTYMK PIK3R1 2181/4885PIK3CA 1837/4885SPR 920/4885

“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.