SCHEMBL5647638

SCHEMBL5647638

CCN(CC)Cc1cnc2cc(NC(=O)c3ccc(-c4ccc(Cl)cc4)cc3)c(OC)cc2c1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
F10 P00742 1/20 0.50
KDM4E B2RXH2 3/20 0.48
NPSR1 Q6W5P4 1/20 0.48
MCHR1 Q99705 8/20 0.45
HTR2C P28335 5/20 0.45
HDAC1 Q13547 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
MAPT P10636 4/20 0.43
TP53 P04637 1/20 0.43
PDGFRB P09619 2/20 0.43
PDGFRA P16234 2/20 0.43
ALDH1A1 P00352 2/20 0.42
HPGD P15428 1/20 0.42
PTGS2 P35354 1/20 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
SCHEMBL14619979 0.90 MCHR1 (0.43) F10KDM4EMCHR1HTR2CHDAC1
SCHEMBL5644296 0.82 MCHR1 (0.69) KDM4EMCHR1HTR2CMAPTALDH1A1
SCHEMBL5649106 0.81 MCHR1 (0.68) F10KDM4EMCHR1HTR2CMAPT
SCHEMBL5644738 0.81 PDGFRB (0.42) KDM4ETP53PDGFRBPDGFRAALDH1A1
SCHEMBL5646648 0.79 MCHR1 (0.68) F10MCHR1HTR2CMAPTTP53
SCHEMBL5645754 0.72 MCHR1 (0.68) F10MCHR1HTR2CMAPTTP53
SCHEMBL5651130 0.70 MCHR1 (0.83) F10MCHR1HTR2CHDAC1
SCHEMBL5647478 0.70 MCHR1 (0.79) MCHR1HTR2C
SCHEMBL5651141 0.69 MCHR1 (0.86) F10MCHR1HTR2CHDAC1
SCHEMBL5651638 0.69 MCHR1 (0.68) 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 4 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-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 F10 1282/4885KDM4E 2112/4885NPSR1 48/4885

“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.