SCHEMBL4783556

SCHEMBL4783556

COC(=O)c1ccc2c(N3CCN(C)CC3)n[nH]c2c1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.46
MAP2K4 P45985 2/20 0.46
KIT P10721 5/20 0.46
FLT3 P36888 3/20 0.46
FGFR1 P11362 2/20 0.45
KIF11 P52732 1/20 0.44
AURKA O14965 2/20 0.44
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 2/20 0.43
TSHR P16473 1/20 0.43
CHEK1 O14757 1/20 0.43
CDK7 P50613 1/20 0.43
GAA P10253 1/20 0.42
WDR5 P61964 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
SCHEMBL4780938 0.86 MAPK1 (0.48) MAPK1MAP2K4KITFLT3CHEK1
SCHEMBL4783913 0.85 PRKCZ (0.48) MAPK1MAP2K4KITFLT3CHEK1
Lithium Ion SCHEMBL4783900 0.84 MAPK1 (0.45) MAPK1KITFLT3FGFR1
SCHEMBL4783741 0.79 KIT (0.52) KITFLT3KDM4EALDH1A1TSHR
SCHEMBL4781301 0.78 AURKA (0.54) MAPK1KITFLT3FGFR1AURKA
SCHEMBL4785037 0.78 RAB9A (0.54) KDM4EALDH1A1GAA
SCHEMBL4781936 0.77 FLT3 (0.52) MAPK1KITFLT3FGFR1AURKA
SCHEMBL4785283 0.77 KDM4E (0.43) KDM4EALDH1A1TSHRGAAWDR5
SCHEMBL4784235 0.77 KMT2A (0.51) KITAURKA
SCHEMBL4784112 0.77 ALDH1A1 (0.54) MAPK1KITFLT3KDM4EALDH1A1

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-20080153810-A1 INDAZOLE DERIVATIVES USEFUL AS MELANIN CONCENTRATING RECEPTOR LIGANDS FOREST LABORATORIES HOLDINGS LIMITED (BM) 2008-06-26 US disclosed
US-20080153810-A1 INDAZOLE DERIVATIVES USEFUL AS MELANIN CONCENTRATING RECEPTOR LIGANDS FOREST LABORATORIES HOLDINGS LIMITED (BM) 2008-06-26 US disclosed
US-20080153810-A1 INDAZOLE DERIVATIVES USEFUL AS MELANIN CONCENTRATING RECEPTOR LIGANDS FOREST LABORATORIES HOLDINGS LIMITED (BM) 2008-06-26 US disclosed
WO-2008061109-A2 INDAZOLE DERIVATIVES USEFUL AS MELANIN CONCENTRATING RECEPTOR LIGANDS FOREST LABORATORIES HOLDINGS LIMITED (BM) 2008-05-22 WO disclosed
WO-2008061109-A2 INDAZOLE DERIVATIVES USEFUL AS MELANIN CONCENTRATING RECEPTOR LIGANDS FOREST LABORATORIES HOLDINGS LIMITED (BM) 2008-05-22 WO 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-20080153810-A1 INDAZOLE DERIVATIVES USEFUL AS MELANIN CONCENTRATING RECEPTOR LIGANDS MCHR1, MCHR2, MC1R MAPK1 3438/4885MAP2K4 4145/4885KIT 282/4885

“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.