SCHEMBL4783277

SCHEMBL4783277

CN(C)CCN(C)c1n[nH]c2cc(C(=O)O)ccc12.[LiH]

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP2K4 P45985 6/20 0.40
MAPK1 P28482 5/20 0.40
MAPK6 Q16659 4/20 0.40
KIT P10721 1/20 0.40
CSNK2A1 P68400 4/20 0.40
FGFR1 P11362 1/20 0.38
FGFR2 P21802 1/20 0.38
MAPKAPK5 Q8IW41 1/20 0.38
MAPKAPK3 Q16644 2/20 0.38
CSNK2A2 P19784 1/20 0.37
CSNK2B P67870 1/20 0.37
MAPK8 P45983 2/20 0.37
MAPK10 P53779 2/20 0.37
MAPK14 Q16539 2/20 0.37
DYRK1A Q13627 1/20 0.37
ITK Q08881 1/20 0.37
PRKAB2 O43741 1/20 0.37
PRKAG1 P54619 1/20 0.37
PRKAA2 P54646 1/20 0.37
PRKAA1 Q13131 1/20 0.37

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
SCHEMBL4782714 0.99 MAP2K4 (0.41) MAP2K4MAPK1MAPK6KITCSNK2A1
Lithium Ion SCHEMBL4783272 0.86 FGFR1 (0.38) MAPK1KITCSNK2A1FGFR1FGFR2
SCHEMBL4785231 0.77 POLB (0.50) MAPK1MAPK8MAPK10MAPK14ITK
SCHEMBL4784771 0.75 LMNA (0.52) MAPK1MAPK8MAPK10MAPK14
SCHEMBL4785918 0.75 LSS (0.54) MAPK1MAPK10MAPK14
SCHEMBL4782765 0.73 ALDH1A1 (0.51) MAPK1KITMAPK8MAPK10MAPK14
SCHEMBL31746650 0.71 DYRK1A (0.52) MAP2K4MAPK1MAPK6CSNK2A1MAPKAPK5
SCHEMBL1144879 0.71 DYRK1A (0.52) MAP2K4MAPK1MAPK6CSNK2A1MAPKAPK5
SCHEMBL3603415 0.71 KMT2A (0.50) MAP2K4MAPK1MAPK6MAPKAPK5MAPKAPK3
SCHEMBL922195 0.70 PDPK1 (0.53) MAP2K4MAPK1MAPK6CSNK2A1MAPKAPK5

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-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

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 MAP2K4 4145/4885MAPK1 3438/4885MAPK6 3995/4885

“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.