SCHEMBL5645913

SCHEMBL5645913

O=C(Nc1cc2ncc(CN3CCCC3)cc2cc1F)c1ccc(Br)cc1F

nearest known ligand 0.67

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 15/20 0.67
HTR2C P28335 9/20 0.67
FAAH O00519 2/20 0.44
GAA P10253 1/20 0.44

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
SCHEMBL5647100 0.92 MCHR1 (0.67) MCHR1HTR2C
SCHEMBL5644977 0.91 MCHR1 (0.66) MCHR1HTR2CGAA
SCHEMBL5648585 0.89 MCHR1 (0.81) MCHR1HTR2C
SCHEMBL5651759 0.87 MCHR1 (0.81) MCHR1HTR2CFAAH
SCHEMBL5644681 0.87 MCHR1 (0.65) MCHR1HTR2CGAA
SCHEMBL5644919 0.86 MCHR1 (0.71) MCHR1HTR2CFAAH
SCHEMBL27611537 0.86 HTR2C (0.49) MCHR1HTR2CFAAHGAA
SCHEMBL5645891 0.85 MCHR1 (0.70) MCHR1HTR2C
SCHEMBL5648902 0.85 MCHR1 (0.70) MCHR1HTR2C
SCHEMBL14587926 0.84 MCHR1 (0.66) MCHR1HTR2C

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-7183415-B2 Quinoline compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-02-27 US disclosed
US-7183415-B2 Quinoline compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-02-27 US disclosed
US-7183415-B2 Quinoline compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-02-27 US disclosed
US-20050209213-A1 Quinoline compound TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2005-09-22 US disclosed
CN-1585751-A Quinoline compound TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2005-02-23 CN disclosed
EP-1447402-A1 QUINOLINE COMPOUND Takeda Chemical Industries, Ltd. (JP) 2004-08-18 EP 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-20050209213-A1 Quinoline compound MC1R, MC2R, TYR MCHR1 4/4885HTR2C 36/4885FAAH 591/4885

“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.