SCHEMBL4307618

SCHEMBL4307618

CCN(C(=O)Cn1c(=O)c(C(C)C)cc2ccc(OC)cc21)c1nccs1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
ALDH1A1 P00352 2/20 0.39
LMNA P02545 2/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
THRB P10828 1/20 0.38
SRC P12931 2/20 0.37
BTK Q06187 2/20 0.37
LYN P07948 1/20 0.37
KDM4E B2RXH2 1/20 0.36
USP2 O75604 1/20 0.36
HPGD P15428 1/20 0.36
TDP1 Q9NUW8 1/20 0.35
MTNR1A P48039 4/20 0.35
MTNR1B P49286 4/20 0.35
TRPM8 Q7Z2W7 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
SCHEMBL4315489 0.83 ALDH1A1 (0.38) MAPTL3MBTL1ALDH1A1LMNANPC1
SCHEMBL4308806 0.80 MTNR1A (0.39) MAPTL3MBTL1ALDH1A1LMNANPC1
SCHEMBL5199093 0.77 TSPO (0.52) L3MBTL1
SCHEMBL4315111 0.77 MAPT (0.44) MAPTALDH1A1LMNANPC1RAB9A
SCHEMBL4307953 0.76 MAPT (0.43) MAPTTHRBMTNR1AMTNR1B
SCHEMBL4696696 0.75 MTNR1A (0.40) MAPTL3MBTL1ALDH1A1LMNANPC1
SCHEMBL13912956 0.75 MAPT (0.46) MAPTTHRB
SCHEMBL4309637 0.75 MAPT (0.43) MAPTLMNATHRBSRCBTK
SCHEMBL4310849 0.75 OXER1 (0.43) MAPTTHRBMTNR1AMTNR1B
SCHEMBL6047803 0.75 POLB (0.44) MAPTL3MBTL1ALDH1A1LMNANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090062280-A1 Ophthalmic Compositions for Treating Ocular Hypertension MERCK SHARP & DOHME CORP. 2009-03-05 US claimed
EP-2004193-A2 OPHTHALMIC COMPOSITIONS FOR TREATING OCULAR HYPERTENSION Merck & Co., Inc. (US) 2008-12-24 EP claimed
WO-2007108968-A2 OPHTHALMIC COMPOSITIONS FOR TREATING OCULAR HYPERTENSION MERCK & CO., INC. (US) 2007-09-27 WO claimed
US-20090062280-A1 Ophthalmic Compositions for Treating Ocular Hypertension MERCK SHARP & DOHME CORP. 2009-03-05 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 (1 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-20090062280-A1 Ophthalmic Compositions for Treating Ocular Hypertension KCNN3, KCNN1, KCNN2 MAPT 498/4885L3MBTL1 4741/4885ALDH1A1 1707/4885

“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.