SCHEMBL6338073

SCHEMBL6338073

O=C(NC1CCNCC1)c1cc(=O)c2cc(F)ccc2o1

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MCHR1 Q99705 18/20 0.59
▸ KCNH2 Q12809 16/20 0.59
▸ MCHR2 Q969V1 11/20 0.59
▸ ACHE P22303 1/20 0.50
▸ NPC1 O15118 1/20 0.50
▸ RAB9A P51151 1/20 0.50
▸ CYP3A4 P08684 1/20 0.49

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
SCHEMBL6329320 0.91 MCHR1 (0.67) MCHR1KCNH2MCHR2CYP3A4
Hydrochloric Acid SCHEMBL6333738 0.90 MCHR1 (0.66) MCHR1KCNH2MCHR2CYP3A4
SCHEMBL6337803 0.86 MCHR1 (0.59) MCHR1KCNH2MCHR2ACHENPC1
SCHEMBL6331471 0.86 MCHR1 (0.56) MCHR1KCNH2MCHR2ACHE
SCHEMBL6333533 0.82 MCHR1 (0.60) MCHR1KCNH2MCHR2ACHECYP3A4
SCHEMBL6329928 0.82 MCHR1 (0.55) MCHR1KCNH2MCHR2ACHE
SCHEMBL6332263 0.81 MCHR1 (0.57) MCHR1KCNH2ACHE
SCHEMBL6331379 0.80 MCHR1 (0.60) MCHR1KCNH2ACHE
SCHEMBL6337794 0.79 MCHR1 (0.59) MCHR1KCNH2MCHR2ACHE
SCHEMBL6331373 0.78 MCHR1 (0.57) MCHR1KCNH2MCHR2ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050209274-A1 Antagonists of melanin concentrating hormone effects on the melanin concentrating hormone receptor ABOTT LABORATORIES 2005-09-22 — — US disclosed
US-20050187387-A1 Antagonists of melanin concentrating hormone effects on the melanin concentrating hormone receptor ABBOTT LABORATORIES 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 (1 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-20050209274-A1 Antagonists of melanin concentrating hormone effects on the melanin concentrating hormone receptor MCHR1, MCHR2, MC1R MCHR1 1/4885KCNH2 1620/4885MCHR2 2/4885

“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.

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