SCHEMBL5862827

SCHEMBL5862827

O=C(Cc1ccc(OCc2ccccc2)cc1)Nc1cccc2nn(CCN3CCCCC3)cc12

nearest known ligand 0.98

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 7/20 0.98
MCHR2 Q969V1 1/20 0.53
EPHX2 P34913 1/20 0.49
NPC1 O15118 3/20 0.48
RAB9A P51151 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
KDM4E B2RXH2 3/20 0.47
EGFR P00533 2/20 0.47
ALDH1A1 P00352 2/20 0.47
NPY1R P25929 1/20 0.47
HTT P42858 2/20 0.47
HRH3 Q9Y5N1 1/20 0.47
OPRK1 P41145 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46

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
SCHEMBL5862031 0.99 MCHR1 (1.00) MCHR1MCHR2EPHX2NPC1RAB9A
SCHEMBL5862836 0.89 MCHR1 (0.82) MCHR1MCHR2SMN1; SMN2ALDH1A1OPRK1
SCHEMBL5862100 0.86 MCHR1 (0.77) MCHR1MCHR2EPHX2NPC1RAB9A
SCHEMBL5862074 0.85 MCHR1 (0.73) MCHR1SMN1; SMN2OPRK1
SCHEMBL5860797 0.84 MCHR1 (0.74) MCHR1SMN1; SMN2EGFRALDH1A1
SCHEMBL5862055 0.84 MCHR1 (0.74) MCHR1SMN1; SMN2OPRK1
SCHEMBL5862184 0.81 MCHR1 (1.00) MCHR1MCHR2EPHX2
SCHEMBL6069418 0.80 MCHR1 (1.00) MCHR1MCHR2EPHX2NPC1RAB9A
SCHEMBL6069890 0.78 MCHR1 (0.72) MCHR1MCHR2EPHX2NPC1RAB9A
SCHEMBL6069170 0.78 MCHR1 (0.72) MCHR1MCHR2EPHX2NPC1RAB9A

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-7049307-B2 Antagonists of melanin concentrating hormone effects on the melanin concentrating hormone receptor ABBOTT LABORATORIES (US) 2006-05-23 US claimed
US-20050187279-A1 Antagonists of melanin concentrating hormone effects on the melanin concentrating hormone receptor ABBVIE INC. 2005-08-25 US claimed
US-20050137187-A1 Antagonists of melanin concentrating hormone effects on the melanin concentrating hormone receptor ABBOTT LABORATORIES 2005-06-23 US claimed
US-7049307-B2 Antagonists of melanin concentrating hormone effects on the melanin concentrating hormone receptor ABBOTT LABORATORIES (US) 2006-05-23 US disclosed
US-20050187279-A1 Antagonists of melanin concentrating hormone effects on the melanin concentrating hormone receptor ABBVIE INC. 2005-08-25 US disclosed
US-20050137187-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-20050137187-A1 Antagonists of melanin concentrating hormone effects on the melanin concentrating hormone receptor MCHR1, MCHR2, MC1R MCHR1 1/4885MCHR2 2/4885EPHX2 3932/4885
US-20050187279-A1 Antagonists of melanin concentrating hormone effects on the melanin concentrating hormone receptor MCHR1, MCHR2, MC1R MCHR1 1/4885MCHR2 2/4885EPHX2 3932/4885

“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.