SCHEMBL1747209

SCHEMBL1747209

CCCNc1nc(C)c(C)s1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
GAA P10253 2/20 0.43
MAPK14 Q16539 1/20 0.39
MAPT P10636 3/20 0.38
CCNA2 P20248 1/20 0.38
CDK2 P24941 1/20 0.38
NPC1 O15118 7/20 0.38
RAB9A P51151 5/20 0.38
SMN1; SMN2 Q16637 4/20 0.38
PKM P14618 1/20 0.38
NOS1 P29475 1/20 0.37
LMNA P02545 2/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
LIMK1 P53667 1/20 0.37
RAF1 P04049 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
RXFP1 Q9HBX9 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
SCHEMBL13841475 0.79 ALDH1A1 (0.62) ALDH1A1GAAMAPTNPC1RAB9A
SCHEMBL11382152 0.79 HSD17B10 (0.41) ALDH1A1GAAMAPTNPC1RAB9A
SCHEMBL27623174 0.76 ALDH1A1 (0.38) ALDH1A1GAAMAPTNPC1RAB9A
SCHEMBL18483306 0.73 ALDH1A1 (0.42) ALDH1A1GAAMAPTNPC1RAB9A
SCHEMBL8911198 0.73 NPC1 (0.68) ALDH1A1GAAMAPTNPC1RAB9A
SCHEMBL1745496 0.72 MAOA (0.58) ALDH1A1GAAMAPTRAB9AMEN1
SCHEMBL25251560 0.71 ALDH1A1 (0.67) ALDH1A1GAAMAPTNPC1RAB9A
SCHEMBL9965751 0.70
SCHEMBL15899107 0.69
SCHEMBL18469874 0.69

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
EP-1559422-B1 RECEPTOR FUNCTION CONTROLLING AGENT TAKEDA PHARMACEUTICAL (JP) 2014-04-30 EP disclosed
EP-2385032-A1 GPR40 Receptor function regulator Takeda Pharmaceutical Company Limited (JP) 2011-11-09 EP disclosed
US-7960369-B2 Receptor function regulator TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-06-14 US disclosed
US-20090012093-A1 Receptor Function Regulator TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-01-08 US disclosed
EP-1559422-A1 RECEPTOR FUNCTION CONTROLLING AGENT Takeda Pharmaceutical Company Limited (JP) 2005-08-03 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-20090012093-A1 Receptor Function Regulator GPR119, GIPR, INSR ALDH1A1 4258/4885GAA 2417/4885MAPK14 1874/4885

“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.