SCHEMBL4093174

SCHEMBL4093174

N#Cc1cccc(Cn2c(Cl)nc3ccccc32)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CFTR P13569 1/20 0.61
LMNA P02545 2/20 0.53
DRD2 P14416 1/20 0.50
TBXA2R P21731 1/20 0.50
CCR2 P41597 1/20 0.50
TP53 P04637 4/20 0.47
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
NPSR1 Q6W5P4 1/20 0.47
TNF P01375 1/20 0.47
ALDH1A1 P00352 2/20 0.46
PDE6D O43924 1/20 0.46
ALDH2 P05091 1/20 0.46
ALDH3A1 P30838 1/20 0.46
HTR3A P46098 1/20 0.45
MAPT P10636 1/20 0.45
CYP19A1 P11511 1/20 0.45
CYP11B1 P15538 1/20 0.45
CYP11B2 P19099 1/20 0.45
ALOX5AP P20292 1/20 0.45

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
SCHEMBL4092820 0.86 DRD2 (0.64) CFTRLMNADRD2TBXA2RTP53
SCHEMBL17819068 0.84 KMT2A (0.59) CFTRTP53KMT2ATNFALDH1A1
SCHEMBL4083319 0.82 TP53 (0.63) LMNACCR2TP53KMT2AMEN1
SCHEMBL1169953 0.81 LMNA (0.70) CFTRLMNADRD2TBXA2RTP53
SCHEMBL31633144 0.80 TSHR (0.66) LMNATBXA2RTP53KMT2AMEN1
SCHEMBL22481419 0.78 CYP11B2 (0.50) CFTRLMNADRD2TBXA2RCYP19A1
SCHEMBL29668281 0.78 CYP11B2 (0.50) CFTRLMNADRD2TBXA2RCYP19A1
SCHEMBL4083104 0.76 TP53 (0.54) CFTRLMNADRD2TP53KMT2A
SCHEMBL4089473 0.76 MAPT (0.63) LMNATP53KMT2AMEN1NPSR1
SCHEMBL16818463 0.76 CCR2 (0.50) CFTRDRD2TBXA2RCCR2ALDH1A1

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-20090062317-A1 MEDICINAL USE OF RECEPTOR LIGANDS 7TM PHARMA A/S (DK) 2009-03-05 US disclosed
EP-1778670-A2 MEDICINAL USE OF RECEPTOR LIGANDS 7TM Pharma A/S (DK) 2007-05-02 EP disclosed
WO-2006010446-A2 MEDICINAL USE OF RECEPTOR LIGANDS 7TM PHARMA A/S (DK) 2006-02-02 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-20090062317-A1 MEDICINAL USE OF RECEPTOR LIGANDS MCHR1, MCHR2, MC1R CFTR 1980/4885LMNA 2850/4885DRD2 606/4885

“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.