SCHEMBL5860894

SCHEMBL5860894

O=C(Nc1ccc(Oc2ccccc2)cc1)Nc1ccc2cn(CCNCC3CCCO3)nc2c1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 10/20 0.57
NPSR1 Q6W5P4 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
MCHR2 Q969V1 5/20 0.44
RAB9A P51151 2/20 0.44
NPC1 O15118 1/20 0.43
TP53 P04637 1/20 0.43
POLB P06746 1/20 0.43
HPGD P15428 1/20 0.43
MEN1 O00255 1/20 0.42
LMNA P02545 1/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 1/20 0.42
MAPK14 Q16539 1/20 0.41

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
SCHEMBL6374843 0.83 NPSR1 (0.45) MCHR1NPSR1L3MBTL1RAB9AHPGD
SCHEMBL5862038 0.82 MCHR1 (0.64) MCHR1MCHR2MAPK14
SCHEMBL5862087 0.82 MCHR1 (0.65) MCHR1MCHR2HPGD
SCHEMBL5862874 0.80 MCHR1 (0.61) MCHR1MCHR2MEN1KMT2AMAPK14
SCHEMBL5860900 0.80 MCHR1 (0.61) MCHR1MCHR2HPGDMAPK14
SCHEMBL5862003 0.79 MCHR1 (0.65) MCHR1MCHR2MAPK14
SCHEMBL5862161 0.78 MCHR1 (0.64) MCHR1MCHR2LMNAHTT
SCHEMBL5862106 0.78 MCHR1 (0.63) MCHR1MCHR2HPGDMEN1KMT2A
SCHEMBL5860790 0.78 MCHR1 (0.70) MCHR1MCHR2RAB9ANPC1
SCHEMBL5860886 0.78 MCHR1 (0.61) MCHR1MCHR2RAB9ANPC1MAPK14

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 5 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

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 1/4885NPSR1 26/4885L3MBTL1 1965/4885
US-20050187279-A1 Antagonists of melanin concentrating hormone effects on the melanin concentrating hormone receptor MCHR1, MCHR2, MC1R MCHR1 1/4885NPSR1 26/4885L3MBTL1 1965/4885

“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.