SCHEMBL6069755

SCHEMBL6069755

Nc1ccc2cnn(CCN3CCCC3)c2c1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 14/20 0.47
MCHR2 Q969V1 7/20 0.46
HTR2A P28223 1/20 0.46
HTR2C P28335 1/20 0.46
HTR2B P41595 1/20 0.46
BCHE P06276 2/20 0.44
CNR2 P34972 2/20 0.44
SIGMAR1 Q99720 1/20 0.44
CNR1 P21554 1/20 0.42

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
SCHEMBL521061 0.89 HDAC3 (0.47) MCHR1MCHR2HTR2AHTR2CHTR2B
SCHEMBL538977 0.88 MCHR1 (0.53) MCHR1MCHR2
SCHEMBL6069601 0.87 MCHR1 (0.52) MCHR1MCHR2BCHECNR2SIGMAR1
SCHEMBL4539220 0.82 MCHR1 (0.47) MCHR1MCHR2HTR2AHTR2CHTR2B
SCHEMBL17678169 0.82 KMO (0.58) MCHR1MCHR2SIGMAR1
SCHEMBL17678223 0.82 KMO (0.58) MCHR1MCHR2BCHECNR2CNR1
SCHEMBL22890607 0.79 MCHR1 (0.45) MCHR1MCHR2SIGMAR1
SCHEMBL21026147 0.79 MCHR1 (0.47) MCHR1MCHR2SIGMAR1
SCHEMBL21026066 0.79 HTR7 (0.51) MCHR1MCHR2
SCHEMBL29644009 0.79 MCHR1 (0.45) MCHR1MCHR2SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7071182-B2 Antagonists of melanin concentrating hormone effects on the melanin concentrating hormone receptor ABBOTT LABORATORIES (US) 2006-07-04 US disclosed
US-20050277638-A1 Antagonists of melanin concentrating hormone effects on the melanin concentrating hormone receptor ABBVIE INC. 2005-12-15 US disclosed
US-20050137243-A1 Antagonists of melanin concentrating hormone effects on the melanin concentrating hormone receptor ABBOTT LABORATORIES 2005-06-23 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 (2 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-20050137243-A1 Antagonists of melanin concentrating hormone effects on the melanin concentrating hormone receptor MCHR1, MCHR2, MC1R MCHR1 1/4885MCHR2 2/4885HTR2A 71/4885
US-20050277638-A1 Antagonists of melanin concentrating hormone effects on the melanin concentrating hormone receptor MCHR1, MCHR2, MC1R MCHR1 1/4885MCHR2 2/4885HTR2A 71/4885

“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.