SCHEMBL3860740

SCHEMBL3860740

CC(C)(C)[Si](C)(C)OCCNC(=O)CBr

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 1/20 0.34
KDM4E B2RXH2 1/20 0.30
GLA P06280 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
BACE1 P56817 1/20 0.30
DUT P33316 2/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL4744132 0.84 ALDH1A1 (0.41) L3MBTL1BACE1DUTTSHR
SCHEMBL28516262 0.80 MAPK1 (0.40) MTNR1AKDM4EL3MBTL1TSHR
SCHEMBL15941254 0.80 BACE1 (0.32) BACE1DUT
SCHEMBL26121759 0.79 MCL1 (0.50) KDM4E
SCHEMBL15863147 0.79 POLB (0.37) KDM4EBACE1DUT
SCHEMBL14498357 0.78 GAA (0.41) L3MBTL1TSHR
SCHEMBL20163331 0.76 BACE1 (0.32) GLABACE1
SCHEMBL20363234 0.76 KMT2A (0.41) MTNR1ABACE1DUTTSHR
SCHEMBL1143295 0.76 TDP1 (0.49)
SCHEMBL31271525 0.76 BACE1 (0.30) BACE1DUT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160120996-A1 COMPOUNDS AND METHODS FOR TRANS-MEMBRANE DELIVERY OF MOLECULES APOSENSE LTD. (IL) 2016-05-05 US disclosed
EP-1888082-B1 MOTILIDE COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2012-09-12 EP disclosed
US-7582611-B2 Treating disorders of gastric motility; decreasing side effects of erythromycin A PFIZER INC. (US) 2009-09-01 US disclosed
EP-1888082-A4 MOTILIDE COMPOUNDS PFIZER (US) 2008-12-17 EP disclosed
EP-1888082-A1 MOTILIDE COMPOUNDS Pfizer, Inc. (US) 2008-02-20 EP disclosed
WO-2006127252-A1 MOTILIDE COMPOUNDS PFIZER, INC. (US) 2006-11-30 WO disclosed
US-20060270616-A1 Motilide compounds PFIZER INC. 2006-11-30 US disclosed
EP-0838465-A1 Pyridinium-substituted (lactamylvinyl)cephalosporin derivatives, their preparation and their use as antibiotics F. HOFFMANN-LA ROCHE AG (CH) 1998-04-29 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 (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-20060270616-A1 Motilide compounds MLNR, PROKR1, GIPR MTNR1A 17/4885KDM4E 4388/4885GLA 2623/4885
US-20160120996-A1 COMPOUNDS AND METHODS FOR TRANS-MEMBRANE DELIVERY OF MOLECULES ABCB4, LNPK, MBOAT1 MTNR1A 982/4885KDM4E 4823/4885GLA 3516/4885

“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.