SCHEMBL1921409

SCHEMBL1921409

Fc1ccc(C#Cc2ccccc2)c(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 2/20 0.47
APP P05067 1/20 0.44
MAPT P10636 2/20 0.41
NPC1 O15118 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
HPGD P15428 1/20 0.41
CYP2C19 P33261 1/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HSD17B10 Q99714 1/20 0.41
FFAR1 O14842 2/20 0.41
FFAR4 Q5NUL3 1/20 0.41
GRM4 Q14833 1/20 0.40
CA12 O43570 3/20 0.40
CA2 P00918 3/20 0.40

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
SCHEMBL15544149 0.78 MAPT (0.55) PTGDR2APPMAPTNPC1KDM4E
SCHEMBL8187274 0.78 MAPT (0.60) PTGDR2APPMAPTNPC1KDM4E
SCHEMBL1920654 0.76 FFAR1 (0.57) PTGDR2APPMAPTNPC1KDM4E
SCHEMBL31279173 0.76 FFAR1 (0.57) PTGDR2APPMAPTNPC1KDM4E
SCHEMBL29429035 0.74 MAPT (0.60) APPMAPTNPC1KDM4EMEN1
SCHEMBL29001487 0.74 APP (0.44) APPMAPTNPC1KDM4EMEN1
SCHEMBL16478272 0.74 APP (0.40) PTGDR2APPMAPTNPC1KDM4E
SCHEMBL15895659 0.74 FFAR1 (0.44) PTGDR2APPMAPTNPC1KDM4E
SCHEMBL1921687 0.74 ACACB (0.53) APPNPC1MEN1CYP1A2KMT2A
SCHEMBL20886674 0.73 APP (0.48) APPMAPTNPC1KDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8283476-B2 Transition metal catalyzed synthesis of 2H-indazoles SANOFI (FR) 2012-10-09 US disclosed
EP-2134682-B1 A TRANSITION METAL CATALYZED SYNTHESIS OF N-AMINOINDOLES SANOFI SA (FR) 2011-12-14 EP disclosed
US-8026375-B2 Transition metal catalyzed synthesis of N-aminoindoles SANOFI-AVENTIS (FR) 2011-09-27 US disclosed
EP-2170833-B1 A TRANSITION METAL CATALYZED SYNTHESIS OF 2H-INDAZOLES SANOFI AVENTIS (FR) 2011-06-01 EP disclosed
US-20100234601-A1 Transition metal catalyzed synthesis of 2H-indazoles SANOFI-AVENTIS (FR) 2010-09-16 US disclosed
US-20100168429-A1 Transition metal catalyzed synthesis of N-aminoindoles SANOFI-AVENTIS (FR) 2010-07-01 US disclosed
EP-2170833-A1 A TRANSITION METAL CATALYZED SYNTHESIS OF 2H-INDAZOLES Sanofi-Aventis (FR) 2010-04-07 EP disclosed
EP-2134682-A1 A TRANSITION METAL CATALYZED SYNTHESIS OF N-AMINOINDOLES Sanofi-Aventis (FR) 2009-12-23 EP disclosed
WO-2009000411-A1 A TRANSITION METAL CATALYZED SYNTHESIS OF 2H-INDAZOLES SANOFI-AVENTIS (FR) 2008-12-31 WO disclosed
WO-2008125207-A1 A TRANSITION METAL CATALYZED SYNTHESIS OF N-AMINOINDOLES SANOFI-AVENTIS (FR) 2008-10-23 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 (2 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-20100168429-A1 Transition metal catalyzed synthesis of N-aminoindoles NAT1, H1-3, H1-2 PTGDR2 1904/4885APP 3821/4885MAPT 2698/4885
US-20100234601-A1 Transition metal catalyzed synthesis of 2H-indazoles H1-3, H1-2, H1-4 PTGDR2 1691/4885APP 4673/4885MAPT 4103/4885

“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.