SCHEMBL5645408

SCHEMBL5645408

Cc1cc2cc(CN3CCC(C(N)=O)CC3)cnc2cc1NC(=O)c1ccc(-c2ccc(F)cc2)cc1

nearest known ligand 0.80

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 16/20 0.80
HTR2C P28335 11/20 0.80
ACKR3 P25106 1/20 0.52
ALK Q9UM73 1/20 0.48
HDAC1 Q13547 1/20 0.48
F10 P00742 1/20 0.47

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
SCHEMBL5651122 0.91 MCHR1 (0.76) MCHR1HTR2CACKR3
SCHEMBL5645850 0.91 MCHR1 (0.79) MCHR1HTR2CACKR3
SCHEMBL5649494 0.90 MCHR1 (0.77) MCHR1HTR2CACKR3HDAC1
SCHEMBL5647203 0.90 MCHR1 (0.77) MCHR1HTR2CACKR3
SCHEMBL5646746 0.90 MCHR1 (0.81) MCHR1HTR2CACKR3
SCHEMBL5644487 0.89 MCHR1 (0.75) MCHR1HTR2CACKR3HDAC1
SCHEMBL5646824 0.89 MCHR1 (0.75) MCHR1HTR2CACKR3
SCHEMBL5647406 0.89 MCHR1 (1.00) MCHR1HTR2CHDAC1
SCHEMBL5645067 0.88 MCHR1 (0.74) MCHR1HTR2CACKR3HDAC1
SCHEMBL5649184 0.88 MCHR1 (0.98) MCHR1HTR2CHDAC1

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-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
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 36/4885ACKR3 596/4885

“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.