SCHEMBL5862055

SCHEMBL5862055

O=C(Cc1cccc(Oc2ccccc2)c1)Nc1cccc2nn(CCN3CCCC3)cc12

nearest known ligand 0.74

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 8/20 0.74
GAA P10253 3/20 0.47
KCNQ2 O43526 1/20 0.47
OPRK1 P41145 1/20 0.45
HPGD P15428 1/20 0.44
POLB P06746 1/20 0.44
CCR8 P51685 1/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
OPRL1 P41146 1/20 0.42
FAAH O00519 1/20 0.41
PRKACA P17612 1/20 0.41
ROCK1 Q13464 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
SCHEMBL5862074 0.99 MCHR1 (0.73) MCHR1GAAKCNQ2OPRK1HPGD
SCHEMBL5862836 0.93 MCHR1 (0.82) MCHR1GAAKCNQ2OPRK1MEN1
SCHEMBL5862031 0.85 MCHR1 (1.00) MCHR1OPRK1SMN1; SMN2
SCHEMBL5862827 0.84 MCHR1 (0.98) MCHR1OPRK1SMN1; SMN2
SCHEMBL5862204 0.83 MCHR1 (0.63) MCHR1GAAPOLBMEN1KMT2A
SCHEMBL6069427 0.80 MCHR1 (0.74) MCHR1GAAKCNQ2
SCHEMBL5862138 0.76 MCHR1 (0.82) MCHR1MEN1KMT2A
SCHEMBL5860926 0.75 MCHR1 (0.81) MCHR1MEN1KMT2A
SCHEMBL5862173 0.75 MCHR1 (0.59) MCHR1HPGDPOLBMEN1KMT2A
SCHEMBL5861242 0.74 MCHR1 (0.58) MCHR1HPGDPOLBKMT2ASMN1; SMN2

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 1/4885GAA 381/4885KCNQ2 1546/4885
US-20050187279-A1 Antagonists of melanin concentrating hormone effects on the melanin concentrating hormone receptor MCHR1, MCHR2, MC1R MCHR1 1/4885GAA 381/4885KCNQ2 1546/4885

“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.