SCHEMBL5862836

SCHEMBL5862836

O=C(Cc1ccc(Oc2ccccc2)cc1)Nc1cccc2nn(CCN3CCCC3)cc12

nearest known ligand 0.82

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 12/20 0.82
OPRK1 P41145 1/20 0.46
KCNQ2 O43526 2/20 0.44
GAA P10253 3/20 0.44
KMT2A Q03164 3/20 0.44
ALDH1A1 P00352 2/20 0.44
MEN1 O00255 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
GLA P06280 1/20 0.42
PKM P14618 1/20 0.42
MCHR2 Q969V1 2/20 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
SCHEMBL5862055 0.93 MCHR1 (0.74) MCHR1OPRK1KCNQ2GAAKMT2A
SCHEMBL5862074 0.92 MCHR1 (0.73) MCHR1OPRK1KCNQ2GAAKMT2A
SCHEMBL5862031 0.90 MCHR1 (1.00) MCHR1OPRK1ALDH1A1SMN1; SMN2MCHR2
SCHEMBL5862827 0.89 MCHR1 (0.98) MCHR1OPRK1ALDH1A1SMN1; SMN2MCHR2
SCHEMBL5862204 0.86 MCHR1 (0.63) MCHR1GAAKMT2AALDH1A1MEN1
SCHEMBL5862138 0.81 MCHR1 (0.82) MCHR1KMT2AALDH1A1MEN1GLA
SCHEMBL5860926 0.80 MCHR1 (0.81) MCHR1KMT2AALDH1A1MEN1GLA
SCHEMBL6069326 0.80 MCHR1 (0.82) MCHR1OPRK1MCHR2
SCHEMBL6070315 0.79 MCHR1 (0.81) MCHR1OPRK1GAAKMT2AMEN1
SCHEMBL5862100 0.77 MCHR1 (0.77) MCHR1ALDH1A1SMN1; SMN2MCHR2

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 1/4885OPRK1 232/4885KCNQ2 1546/4885
US-20050187279-A1 Antagonists of melanin concentrating hormone effects on the melanin concentrating hormone receptor MCHR1, MCHR2, MC1R MCHR1 1/4885OPRK1 232/4885KCNQ2 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.