SCHEMBL1921623

SCHEMBL1921623

COc1ccc(C#Cc2ccccc2Cl)cc1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
APP P05067 2/20 0.52
KCNH2 Q12809 2/20 0.49
FFAR1 O14842 2/20 0.48
L3MBTL1 Q9Y468 3/20 0.46
MAPT P10636 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
ACACB O00763 3/20 0.45
RELA Q04206 1/20 0.44
NFE2L2 Q16236 1/20 0.44
SLC16A3 O15427 1/20 0.43
KMT2A Q03164 1/20 0.42
GRM5 P41594 1/20 0.42
POLB P06746 2/20 0.41
GAA P10253 1/20 0.41
PDE4D Q08499 1/20 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
SCHEMBL28308740 0.87 APP (0.61) APPKCNH2FFAR1L3MBTL1TDP1
SCHEMBL1920649 0.85 CYP1A2 (0.49) APPKCNH2FFAR1L3MBTL1MAPT
SCHEMBL10412693 0.80 FFAR1 (0.60) APPKCNH2FFAR1L3MBTL1ACACB
SCHEMBL28353258 0.80 APP (0.58) APPKCNH2FFAR1L3MBTL1MAPT
SCHEMBL1921687 0.79 ACACB (0.53) APPKCNH2FFAR1L3MBTL1ACACB
SCHEMBL1923029 0.79 ACACB (0.52) APPKCNH2FFAR1L3MBTL1MAPT
SCHEMBL28520315 0.79 APP (0.52) APPKCNH2FFAR1L3MBTL1TDP1
SCHEMBL29120782 0.79 APP (0.52) APPKCNH2FFAR1L3MBTL1TDP1
SCHEMBL28368555 0.79 POLB (0.57) APPKCNH2FFAR1L3MBTL1MAPT
SCHEMBL28296194 0.79 ALDH1A1 (0.63) APPKCNH2FFAR1L3MBTL1MAPT

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-8283476-B2 Transition metal catalyzed synthesis of 2H-indazoles SANOFI (FR) 2012-10-09 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
EP-2170833-A1 A TRANSITION METAL CATALYZED SYNTHESIS OF 2H-INDAZOLES Sanofi-Aventis (FR) 2010-04-07 EP disclosed
WO-2009000411-A1 A TRANSITION METAL CATALYZED SYNTHESIS OF 2H-INDAZOLES SANOFI-AVENTIS (FR) 2008-12-31 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-20100234601-A1 Transition metal catalyzed synthesis of 2H-indazoles H1-3, H1-2, H1-4 APP 4673/4885KCNH2 41/4885FFAR1 4444/4885

“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.