SCHEMBL5199093

SCHEMBL5199093

CCN(C(=O)Cn1c2ccccc2c2ccc(OC)cc21)c1nccs1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSPO P30536 16/20 0.52
DYRK1A Q13627 2/20 0.42
PSEN1 P49768 1/20 0.41
PSEN2 P49810 1/20 0.41
APH1B Q8WW43 1/20 0.41
NCSTN Q92542 1/20 0.41
APH1A Q96BI3 1/20 0.41
PSENEN Q9NZ42 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL4119752 0.83 ALDH1A1 (0.43) TSPODYRK1AL3MBTL1
SCHEMBL6047803 0.82 POLB (0.44) TSPOL3MBTL1
SCHEMBL4110311 0.81 ALDH1A1 (0.46) TSPODYRK1AL3MBTL1
SCHEMBL13844056 0.79 ELANE (0.39) L3MBTL1
SCHEMBL4580316 0.79 L3MBTL1 (0.37) TSPODYRK1AL3MBTL1
SCHEMBL4696696 0.79 MTNR1A (0.40) TSPOL3MBTL1
SCHEMBL13844071 0.77 ALDH1A1 (0.37) DYRK1AL3MBTL1
SCHEMBL4019852 0.77 L3MBTL1 (0.36) DYRK1AL3MBTL1
SCHEMBL4307618 0.77 MAPT (0.41) L3MBTL1
SCHEMBL6047777 0.77 L3MBTL1 (0.40) TSPOL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070293558-A1 Ophthalmic Compositions for Treating Ocular Hypertension MERCK SHARP & DOHME CORP. 2007-12-20 US claimed
EP-1802299-A2 OPHTHALMIC COMPOSITIONS FOR TREATING OCULAR HYPERTENSION Merck & Co., Inc. (US) 2007-07-04 EP claimed
WO-2006044425-A2 OPHTHALMIC COMPOSITIONS FOR TREATING OCULAR HYPERTENSION MERCK & CO., INC. (US) 2006-04-27 WO claimed
US-20070293558-A1 Ophthalmic Compositions for Treating Ocular Hypertension MERCK SHARP & DOHME CORP. 2007-12-20 US disclosed
EP-1802299-A2 OPHTHALMIC COMPOSITIONS FOR TREATING OCULAR HYPERTENSION Merck & Co., Inc. (US) 2007-07-04 EP disclosed
WO-2006044425-A2 OPHTHALMIC COMPOSITIONS FOR TREATING OCULAR HYPERTENSION MERCK & CO., INC. (US) 2006-04-27 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 (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-20070293558-A1 Ophthalmic Compositions for Treating Ocular Hypertension KCNH2, KCNJ11, KCNN1 TSPO 936/4885DYRK1A 4545/4885PSEN1 188/4885

“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.