SCHEMBL14034145

SCHEMBL14034145

Cc1nc2c(c(C(F)(F)F)c1C#N)CCCC2

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.54
MAPT P10636 1/20 0.54
KDM4E B2RXH2 15/20 0.49
ALDH1A1 P00352 11/20 0.49
HPGD P15428 9/20 0.49
HSD17B10 Q99714 4/20 0.49
MAPK1 P28482 2/20 0.49
TSHR P16473 2/20 0.49
GAA P10253 2/20 0.49
KMT2A Q03164 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
NSD2 O96028 1/20 0.45
L3MBTL1 Q9Y468 3/20 0.44
USP2 O75604 2/20 0.43
HTT P42858 1/20 0.43
POLB P06746 1/20 0.40
LMNA P02545 1/20 0.40
CASP1 P29466 1/20 0.38
MAPK10 P53779 1/20 0.38
CASP7 P55210 1/20 0.38

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
SCHEMBL30501086 0.81 MAPK1 (0.66) TDP1MAPTKDM4EALDH1A1HPGD
SCHEMBL23783191 0.81 MAPK1 (0.66) TDP1MAPTKDM4EALDH1A1HPGD
SCHEMBL22020516 0.72 MAPT (0.39) TDP1MAPTKDM4EALDH1A1HPGD
SCHEMBL22021011 0.71 KDM4E (0.39) TDP1MAPTKDM4EALDH1A1HPGD
SCHEMBL21963219 0.69 ACHE (0.50) KDM4EMAPK1KMT2ALMNA
SCHEMBL31475621 0.69 ACHE (0.50) KDM4EMAPK1KMT2ALMNA
SCHEMBL23782824 0.68 AR (0.39) TDP1MAPTKDM4EALDH1A1HPGD
SCHEMBL29740364 0.68 AR (0.39) TDP1MAPTKDM4EALDH1A1HPGD
SCHEMBL23782782 0.66 KDM4E (0.59) KDM4EALDH1A1HPGDHSD17B10MAPK1
SCHEMBL23783069 0.66 NSD2 (0.72) KDM4EALDH1A1HPGDHSD17B10MAPK1

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-20080293745-A1 New amino-alkyl-amide derivatives as CCR3 receptor ligands SANOFI-AVENTIS (FR) 2008-11-27 US disclosed
WO-2007034251-A1 AMINO-ALKYL-AMIDE DERIVATIVES AS CCR3 RECEPTOR LIGANDS SANOFI-AVENTIS (FR) 2007-03-29 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-20080293745-A1 New amino-alkyl-amide derivatives as CCR3 receptor ligands CCR3, CCR1, CCR4 TDP1 4674/4885MAPT 4311/4885KDM4E 3442/4885

“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.