SCHEMBL5582685

SCHEMBL5582685

CC(=O)Nc1ccc2c(c1)CC(CN(C)C)C2

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 15/20 0.54
CYP1A2 P05177 1/20 0.47
ADRA2A P08913 1/20 0.47
MAOA P21397 1/20 0.47
SLC6A2 P23975 1/20 0.47
HTR2C P28335 1/20 0.47
SLC6A4 P31645 1/20 0.47
HTR2B P41595 1/20 0.47
KDM4E B2RXH2 1/20 0.44
MAPT P10636 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
SCHEMBL4623021 0.89 MCHR1 (0.67) MCHR1
Hydrochloric Acid SCHEMBL4623662 0.88 MCHR1 (0.66) MCHR1
SCHEMBL12355679 0.84 CYP1A2 (0.50) CYP1A2ADRA2AMAOASLC6A2HTR2C
Hydrochloric Acid SCHEMBL6578434 0.82 MCHR1 (0.70) MCHR1
SCHEMBL7826703 0.82 MTNR1A (0.46) MCHR1HTR2CHTR2BKDM4EMAPT
SCHEMBL12355697 0.81 FYN (0.50) MCHR1CYP1A2ADRA2AMAOASLC6A2
SCHEMBL2249768 0.81 HTR2C (0.50) CYP1A2ADRA2AMAOASLC6A2HTR2C
SCHEMBL7254679 0.80 MCHR1 (0.85) MCHR1
SCHEMBL2250545 0.79 CYP1A2 (0.46) MCHR1CYP1A2ADRA2AMAOASLC6A2
SCHEMBL2246315 0.79 CYP1A2 (0.54) CYP1A2ADRA2AMAOASLC6A2HTR2C

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-20070173498-A1 Melanin concentrating hormone antagonist KATO KANEYOSHI 2007-07-26 US disclosed
US-20070173498-A1 Melanin concentrating hormone antagonist KATO KANEYOSHI 2007-07-26 US disclosed
US-20070173498-A1 Melanin concentrating hormone antagonist KATO KANEYOSHI 2007-07-26 US disclosed
US-7115750-B1 Melanin concentrating hormone antagonist TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-10-03 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-20070173498-A1 Melanin concentrating hormone antagonist MC1R, MCHR1, MCHR2 MCHR1 2/4885CYP1A2 1433/4885ADRA2A 204/4885

“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.