SCHEMBL4155674

SCHEMBL4155674

CC(C)(C)OC(=O)N1CC[C@@H](O[Si](C)(C)C(C)(C)C)C1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 6/20 0.46
RECQL P46063 1/20 0.46
HPGD P15428 1/20 0.44
USP2 O75604 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
EPHX1 P07099 1/20 0.43
USP30 Q70CQ3 1/20 0.42
GPR119 Q8TDV5 3/20 0.42
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
PRMT5 O14744 1/20 0.40
WDR77 Q9BQA1 1/20 0.40
PIK3CA P42336 1/20 0.40
PIK3CB P42338 1/20 0.40
PIK3CG P48736 1/20 0.40

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
SCHEMBL4155678 1.00 PIK3CD (0.46) PIK3CDRECQLHPGDUSP2SMN1; SMN2
SCHEMBL25042385 0.92 MEN1 (0.48) PIK3CDRECQLHPGDUSP2SMN1; SMN2
SCHEMBL7387538 0.91 RECQL (0.51) RECQLHPGDUSP2SMN1; SMN2EPHX1
SCHEMBL30987099 0.88 USP2 (0.56) PIK3CDRECQLHPGDUSP2SMN1; SMN2
SCHEMBL13167071 0.88 NR1H2 (0.46) PIK3CDRECQLHPGDUSP2SMN1; SMN2
SCHEMBL30987034 0.85 MAPT (0.40) PIK3CDRECQLHPGDUSP2SMN1; SMN2
SCHEMBL2878174 0.83 PPM1D (0.34) PIK3CDRECQLSMN1; SMN2USP30
SCHEMBL21954152 0.83 PPM1D (0.34) PIK3CDRECQLSMN1; SMN2USP30
SCHEMBL30918741 0.83 EPHX2 (0.35) PIK3CDSMN1; SMN2EPHX1PIK3CAPIK3CB
SCHEMBL2873724 0.83 PPM1D (0.34) PIK3CDRECQLSMN1; SMN2USP30

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9987276-B2 Substituted 2,4-diaminopyrimidines as kinase inhibitors CELGENE CAR LLC (BM) 2018-06-05 US disclosed
US-8329741-B2 Substituted pyrrolidine compounds with central nervous system activity THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 2012-12-11 US disclosed
US-8329741-B2 Substituted pyrrolidine compounds with central nervous system activity THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 2012-12-11 US disclosed
US-20100249092-A1 HETEROARYL COMPOUNDS AND USES THEREOF AVILA THERAPEUTICS, INC. (US) 2010-09-30 US disclosed
US-20090048329-A1 Substituted Pyrrolidine Compounds With Central Nervous System Activity NIH-DEITR 2009-02-19 US disclosed
US-20090048329-A1 Substituted Pyrrolidine Compounds With Central Nervous System Activity NIH-DEITR 2009-02-19 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-20090048329-A1 Substituted Pyrrolidine Compounds With Central Nervous System Activity SLC6A3, SLC18A2, SLC6A2 PIK3CD 1685/4885RECQL 4390/4885HPGD 2321/4885
US-20100249092-A1 HETEROARYL COMPOUNDS AND USES THEREOF ABCG2, CYP3A43, CYP3A5 PIK3CD 1571/4885RECQL 812/4885HPGD 1580/4885

“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.