SCHEMBL2157516

SCHEMBL2157516

CCCC(CCC)CN(C(=O)O)c1cccc(C(=O)CCNC(=O)OC(C)(C)C)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.36
GAA P10253 1/20 0.36
KMT2A Q03164 1/20 0.36
GPR88 Q9GZN0 1/20 0.35
NQO2 P16083 1/20 0.35
NR1H4 Q96RI1 1/20 0.35
CA1 P00915 3/20 0.34
CA2 P00918 3/20 0.34
CA12 O43570 1/20 0.34
CA14 Q9ULX7 1/20 0.34
CTSK P43235 3/20 0.34
KDM4E B2RXH2 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
JAK3 P52333 1/20 0.34
BTK Q06187 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
DRD2 P14416 2/20 0.34
MALT1 Q9UDY8 1/20 0.34
IDO1 P14902 1/20 0.34
SIGMAR1 Q99720 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
SCHEMBL2164881 0.83 NR1H4 (0.45) KMT2ANR1H4L3MBTL1IDO1SIGMAR1
SCHEMBL2821039 0.83 GPR88 (0.39) MEN1GAAKMT2AGPR88NQO2
SCHEMBL2779187 0.80 SIGMAR1 (0.45) NQO2NR1H4CA1CA2CTSK
SCHEMBL2151042 0.80 SIGMAR1 (0.48) KMT2ANR1H4CTSKL3MBTL1TDP1
SCHEMBL2168456 0.79 NR1H4 (0.44) KMT2ANQO2NR1H4L3MBTL1IDO1
SCHEMBL2150723 0.79 ACACB (0.40) MEN1KMT2ANQO2NR1H4CA1
SCHEMBL1725089 0.78 CA2 (0.43) MEN1GAAKMT2AGPR88NQO2
SCHEMBL3135260 0.78 HDAC1 (0.37) NR1H4CA1CA2CA12KDM4E
SCHEMBL1724922 0.77 MALT1 (0.38) MEN1GAAKMT2AGPR88NQO2
SCHEMBL2164206 0.76 SIGMAR1 (0.44) NQO2NR1H4CTSKKDM4EDRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160145198-A1 COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS ACUCELA INC. 2016-05-26 US disclosed
US-9193669-B2 Compounds for treating ophthalmic diseases and disorders ACUCELA INC. (US) 2015-11-24 US disclosed
US-20140228443-A1 COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS ACUCELA INC. (US) 2014-08-14 US disclosed
US-8674137-B2 Compounds for treating ophthalmic diseases and disorders ACUCELA INC. (US) 2014-03-18 US disclosed
EP-2340242-A2 COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS Acucela, Inc. (US) 2011-07-06 EP disclosed
US-20100113539-A1 COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS ACUCELA, INC. (US) 2010-05-06 US disclosed
WO-2010048332-A2 COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS ACUCELA, INC. (US) 2010-04-29 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 (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-20100113539-A1 COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS PDE6D, CLN6, ALDH1A2 MEN1 3659/4885GAA 34/4885KMT2A 4546/4885
US-20160145198-A1 COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS PDE6D, CLN6, ALDH1A2 MEN1 3659/4885GAA 34/4885KMT2A 4546/4885
US-20140228443-A1 COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS PDE6D, CLN6, ALDH1A2 MEN1 3659/4885GAA 34/4885KMT2A 4546/4885

“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.