SCHEMBL14092152

SCHEMBL14092152

C[C@H](CO[Si](C)(C)C(C)(C)C)Oc1cccnc1Br

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 3/20 0.36
S1PR4 O95977 1/20 0.35
DHFR P00374 2/20 0.32
DCPS Q96C86 2/20 0.32
MEN1 O00255 1/20 0.31
POLB P06746 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL27094486 0.87 S1PR4 (0.36) MCHR1S1PR4MEN1POLBKMT2A
SCHEMBL27094490 0.87 S1PR4 (0.36) MCHR1S1PR4MEN1POLBKMT2A
SCHEMBL20079188 0.79 MCHR1 (0.33) MCHR1MEN1POLBKMT2A
SCHEMBL20900494 0.78 MCHR1 (0.33) MCHR1
SCHEMBL238858 0.77 S1PR4 (0.50) S1PR4MEN1POLBKMT2A
SCHEMBL15291940 0.75 HTR1A (0.32) MCHR1
SCHEMBL23272849 0.74 MCHR1 (0.35) MCHR1DHFRDCPS
SCHEMBL29823238 0.74 MCHR1 (0.35) MCHR1DHFRDCPS
SCHEMBL23272848 0.74 MCHR1 (0.35) MCHR1DHFRDCPS
SCHEMBL15060240 0.73 ADRA2A (0.42) MCHR1DHFRDCPSMEN1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9949949-B2 Macrocyclic ghrelin receptor modulators and methods of using the same OCERA THERAPEUTICS, INC. (US) 2018-04-24 US disclosed
US-20170042858-A1 MACROCYCLIC GHRELIN RECEPTOR MODULATORS AND METHODS OF USING THE SAME MALLINCKRODT PHARMA IP TRADING UNLIMITED COMPANY 2017-02-16 US disclosed
EP-2118080-B1 MACROCYCLIC GHRELIN RECEPTOR MODULATORS AND METHODS OF USING THE SAME OCERA THERAPEUTICS INC (US) 2016-08-31 EP disclosed
US-9371297-B2 Macrocyclic ghrelin receptor modulators and methods of using the same OCERA THERAPEUTICS, INC. (US) 2016-06-21 US disclosed
US-20080194672-A1 MACROCYCLIC GHRELIN RECEPTOR MODULATORS AND METHODS OF USING THE SAME TRANZYME PHARMA INC. 2008-08-14 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-20170042858-A1 MACROCYCLIC GHRELIN RECEPTOR MODULATORS AND METHODS OF USING THE SAME GHSR, GHRHR, GIPR MCHR1 71/4885S1PR4 746/4885DHFR 4133/4885
US-20080194672-A1 MACROCYCLIC GHRELIN RECEPTOR MODULATORS AND METHODS OF USING THE SAME GHSR, GHRHR, GIPR MCHR1 75/4885S1PR4 1079/4885DHFR 4140/4885

“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.