SCHEMBL16146431

SCHEMBL16146431

Cc1nc(Nc2ccccc2F)c2nc[nH]c2n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 1/20 0.46
▸ RXFP1 Q9HBX9 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ PTK2 Q05397 1/20 0.40
▸ CDK4 P11802 1/20 0.38
▸ CDK2 P24941 1/20 0.38
▸ HTR2A P28223 1/20 0.38
▸ MAPT P10636 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ FLT1 P17948 1/20 0.37
▸ KDR P35968 1/20 0.37
▸ PIM1 P11309 2/20 0.37
▸ CSNK2B P67870 2/20 0.37
▸ CSNK2A1 P68400 2/20 0.37
▸ PIM2 Q9P1W9 2/20 0.37
▸ KHK P50053 1/20 0.36
▸ EGFR P00533 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ MAPK10 P53779 1/20 0.36
▸ AURKA O14965 1/20 0.35

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
SCHEMBL16146685 0.86 LRRK2 (0.40) LRRK2PTK2HTR2AMAPTHTT
SCHEMBL16146563 0.83 MEN1 (0.49) LRRK2MAPTHTTKHKEGFR
SCHEMBL16146721 0.83 BRAF (0.46) LRRK2PTK2MAPTHTTKDR
SCHEMBL16146160 0.83 IGF1R (0.45) RXFP1L3MBTL1CDK4CDK2MAPT
SCHEMBL11015319 0.80 CYP3A4 (0.46) RXFP1CDK2MAPTKDREGFR
SCHEMBL30523370 0.80 BRAF (0.51) LRRK2PTK2
SCHEMBL16146432 0.80 BRAF (0.51) LRRK2PTK2
SCHEMBL11015668 0.79 RXFP1 (0.46) LRRK2RXFP1L3MBTL1PTK2CDK4
SCHEMBL4921917 0.78 PTK2 (0.56) LRRK2PTK2MAPTHTTFLT1
SCHEMBL16146855 0.77 ALDH1A1 (0.44) TP53AURKA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140303112-A1 Method for treating disease or condition susceptible to amelioration by AMPK activators and compounds of formula which are useful to activate AMP-activated protein kinase (AMPK) ENERGENESIS BIOMEDICAL CO., LTD (TW) 2014-10-09 — — US claimed
US-9938279-B2 Method for treating disease or condition susceptible to amelioration by AMPK activators and compounds of formula which are useful to activate AMP-activated protein kinase (AMPK) ENERGENESIS BIOMEDICAL CO., LTD (TW) 2018-04-10 — — US disclosed
US-20140303112-A1 Method for treating disease or condition susceptible to amelioration by AMPK activators and compounds of formula which are useful to activate AMP-activated protein kinase (AMPK) ENERGENESIS BIOMEDICAL CO., LTD (TW) 2014-10-09 — — US 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-20140303112-A1 Method for treating disease or condition susceptible to amelioration by AMPK activators and compounds of formula which are useful to activate AMP-activated protein kinase (AMPK) PRKAG2, PRKAB2, PRKAG1 LRRK2 1427/4885RXFP1 1550/4885L3MBTL1 4013/4885

“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.

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