SCHEMBL6047795

SCHEMBL6047795

CCCN(CCC)C(=O)Cn1c(C(=O)C(C)C)nc2ccc(OC)cc21

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 8/20 0.45
MTNR1B P49286 8/20 0.45
TSPO P30536 2/20 0.40
LMNA P02545 1/20 0.40
POLB P06746 1/20 0.40
MC4R P32245 1/20 0.39
MC5R P33032 1/20 0.39
MC3R P41968 1/20 0.39
MC1R Q01726 1/20 0.39

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
SCHEMBL6047829 0.96 MTNR1A (0.42) MTNR1AMTNR1BTSPOLMNAMC4R
SCHEMBL6047776 0.94 MTNR1A (0.43) MTNR1AMTNR1BTSPOLMNAPOLB
SCHEMBL6047818 0.91 MC4R (0.48) MTNR1AMTNR1BMC4RMC5RMC3R
SCHEMBL6047791 0.91 MTNR1A (0.41) MTNR1AMTNR1BTSPOLMNAMC4R
SCHEMBL6047808 0.90 KDM4E (0.43) MTNR1AMTNR1BTSPOLMNAMC4R
SCHEMBL6047772 0.88 MC4R (0.43) MTNR1AMTNR1BTSPOMC4RMC5R
SCHEMBL4697988 0.88 MC4R (0.46) MTNR1AMTNR1BTSPOMC4RMC5R
SCHEMBL6047881 0.86 MTNR1A (0.41) MTNR1AMTNR1BTSPO
SCHEMBL6047815 0.85 MTNR1A (0.43) MTNR1AMTNR1BTSPOLMNAPOLB
SCHEMBL6047887 0.84 POLB (0.53) MTNR1AMTNR1BTSPOLMNAPOLB

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 2 patents. 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
US-20060148805-A1 Opthalmic compositions for treating ocular hypertension MERCK SHARP & DOHME CORP. 2006-07-06 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-20060148805-A1 Opthalmic compositions for treating ocular hypertension KCNH2, KCNH3, KCNN1 MTNR1A 799/4885MTNR1B 531/4885TSPO 491/4885

“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.