SCHEMBL2436796

SCHEMBL2436796

CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)C1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.42
USP2 O75604 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PIK3CD O00329 1/20 0.39
CHRM2 P08172 1/20 0.39
CHRM1 P11229 1/20 0.39
CHRM3 P20309 1/20 0.39
RECQL P46063 1/20 0.37
HPGD P15428 1/20 0.35
EPHX1 P07099 1/20 0.34
GPR119 Q8TDV5 1/20 0.34
DDB1 Q16531 1/20 0.34
CRBN Q96SW2 1/20 0.34
NAMPT P43490 1/20 0.34
USP30 Q70CQ3 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
SCHEMBL5508969 1.00 NR1H2 (0.42) NR1H2USP2SMN1; SMN2PIK3CDCHRM2
SCHEMBL342821 1.00 NR1H2 (0.42) NR1H2USP2SMN1; SMN2PIK3CDCHRM2
SCHEMBL24337574 0.92 NR1H2 (0.40) NR1H2USP2SMN1; SMN2PIK3CDCHRM2
SCHEMBL29459509 0.92 NR1H2 (0.40) NR1H2USP2SMN1; SMN2PIK3CDCHRM2
SCHEMBL17322163 0.85 NR1H2 (0.42) NR1H2USP2SMN1; SMN2CHRM2CHRM1
SCHEMBL30781896 0.84 NR1H2 (0.41) NR1H2USP2SMN1; SMN2CHRM2CHRM1
SCHEMBL28837584 0.84 NR1H2 (0.41) NR1H2USP2SMN1; SMN2CHRM2CHRM1
SCHEMBL28766627 0.84 NR1H2 (0.41) NR1H2USP2SMN1; SMN2CHRM2CHRM1
SCHEMBL476249 0.83 PPM1D (0.30)
SCHEMBL19408581 0.83 PPM1D (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10093660-B2 Sulfoximine substituted quinazolines for pharmaceutical compositions EVOTEC INTERNATONAL GMBH (DE) 2018-10-09 US disclosed
EP-3077383-B1 SULFOXIMINE SUBSTITUTED QUINAZOLINES FOR PHARMACEUTICAL COMPOSITIONS EVOTEC INT GMBH (DE) 2018-08-22 EP disclosed
US-20170174668-A1 SULFOXIMINE SUBSTITUTED QUINAZOLINES FOR PHARMACEUTICAL COMPOSITIONS EVOTEC INTERNATIONAL GMBH (DE) 2017-06-22 US disclosed
EP-3077383-A1 SULFOXIMINE SUBSTITUTED QUINAZOLINES FOR PHARMACEUTICAL COMPOSITIONS Evotec International GmbH (DE) 2016-10-12 EP disclosed
WO-2015082324-A1 SULFOXIMINE SUBSTITUTED QUINAZOLINES FOR PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-06-11 WO disclosed
EP-1346982-B1 VLA-4 INHIBITORS DAIICHI SEIYAKU CO (JP) 2011-09-14 EP disclosed
US-7157487-B2 Vla-4 inhibitors DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-01-02 US disclosed
US-7157487-B2 Vla-4 inhibitors DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-01-02 US disclosed
US-20040110945-A1 Vla-4 inhibitors DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-06-10 US disclosed
EP-1346982-A1 VLA-4 INHIBITORS DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2003-09-24 EP 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 (3 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-20040110945-A1 Vla-4 inhibitors VCAM1, ITGA1, ITGB4 NR1H2 533/4885USP2 4531/4885SMN1; SMN2 3702/4885
US-20170174668-A1 SULFOXIMINE SUBSTITUTED QUINAZOLINES FOR PHARMACEUTICAL COMPOSITIONS NEK5, NEK2, SIK2 NR1H2 1915/4885USP2 3264/4885SMN1; SMN2 279/4885
US-10093660-B2 Sulfoximine substituted quinazolines for pharmaceutical compositions NEK5, NEK2, SIK2 NR1H2 1915/4885USP2 3264/4885SMN1; SMN2 279/4885

“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.