SCHEMBL6047802

SCHEMBL6047802

CCN(Cc1ccccc1)C(=O)Cn1c(C(=O)C(C)(C)C)nc2ccc(OC)cc21

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSPO P30536 12/20 0.53
TP53 P04637 3/20 0.49
RXFP1 Q9HBX9 1/20 0.49
GAA P10253 1/20 0.44
ACSS2 Q9NR19 1/20 0.44

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
SCHEMBL4780614 0.88 TSPO (0.44) TSPOACSS2
SCHEMBL6047812 0.87 TSPO (0.43) TSPOACSS2
SCHEMBL6047793 0.85 TSPO (0.41) TSPOACSS2
SCHEMBL6047769 0.85 KDM4E (0.43) TSPOGAAACSS2
SCHEMBL6047815 0.84 MTNR1A (0.43) TSPOACSS2
SCHEMBL6047874 0.83 MC4R (0.45) TSPOACSS2
SCHEMBL4696223 0.83 MTNR1A (0.43) TSPOGAAACSS2
SCHEMBL4696635 0.82 BRD4 (0.53) TSPOTP53ACSS2
SCHEMBL6047822 0.82 MC4R (0.42) TSPO
SCHEMBL6047805 0.81 MTNR1A (0.41) TSPOGAAACSS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060148805-A1 Opthalmic compositions for treating ocular hypertension MERCK SHARP & DOHME CORP. 2006-07-06 US claimed

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-20060148805-A1 Opthalmic compositions for treating ocular hypertension KCNH2, KCNH3, KCNN1 TSPO 491/4885TP53 4722/4885RXFP1 1003/4885

“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.