SCHEMBL2643920

SCHEMBL2643920

N#CCCC1c2c(F)cccc2C(=O)N1Cc1ccc(-n2cccc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 2/20 0.36
HCRTR2 O43614 2/20 0.36
CHRM5 P08912 2/20 0.32
ATM Q13315 1/20 0.32
MEN1 O00255 4/20 0.31
KMT2A Q03164 4/20 0.31
MAPK1 P28482 1/20 0.31
MCHR1 Q99705 1/20 0.31
ALDH1A1 P00352 3/20 0.31
LMNA P02545 2/20 0.31
POLB P06746 2/20 0.31
MAPT P10636 2/20 0.31
TDP1 Q9NUW8 1/20 0.31
KDM4E B2RXH2 1/20 0.31
HPGD P15428 1/20 0.31
HTT P42858 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
NSD2 O96028 1/20 0.30
GRK2 P25098 1/20 0.30

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
SCHEMBL2643454 0.86 ALDH1A1 (0.34) HCRTR1HCRTR2CHRM5ATMMEN1
SCHEMBL2644120 0.83 RORC (0.36) ATMMAPK1ALDH1A1MAPTTDP1
SCHEMBL2644737 0.83 POLB (0.40) HCRTR1HCRTR2MEN1KMT2AMAPK1
SCHEMBL2643529 0.82 CYP2C19 (0.42) MEN1KMT2AALDH1A1POLBCYP1A2
SCHEMBL2643619 0.78 ALDH1A1 (0.42) HCRTR1HCRTR2ATMMEN1KMT2A
SCHEMBL2643303 0.76 MEN1 (0.36) HCRTR1HCRTR2MEN1KMT2AMAPK1
SCHEMBL2643582 0.73 MAPT (0.40) HCRTR1HCRTR2CHRM5ATMMEN1
SCHEMBL2644694 0.71 MAPT (0.39) HCRTR1HCRTR2CHRM5ATMMEN1
SCHEMBL2664915 0.71 CASP3 (0.39) HCRTR1HCRTR2CHRM5ATMMEN1
SCHEMBL2664954 0.71 CASP3 (0.39) HCRTR1HCRTR2CHRM5ATMMEN1

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-8796313-B2 Substituted dihydroisoindolones as allosteric modulators of glucokinase JANSSEN PHARMACEUTICA N.V. (BE) 2014-08-05 US disclosed
US-20070099930-A1 Substituted Dihydroisoindolones As Allosteric Modulators of Glucokinase JANSSEN PHARMACEUTICA N.V. (BE) 2007-05-03 US 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-20070099930-A1 Substituted Dihydroisoindolones As Allosteric Modulators of Glucokinase GCK, GCKR, GPR119 HCRTR1 4602/4885HCRTR2 4122/4885CHRM5 3113/4885

“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.