SCHEMBL2643610

SCHEMBL2643610

O=C(CCC1c2ccccc2C(=O)N1Cc1ccccc1)Nc1nccs1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 1/20 0.55
ALDH1A1 P00352 6/20 0.54
GAA P10253 2/20 0.54
SMN1; SMN2 Q16637 4/20 0.53
HPGD P15428 3/20 0.53
NPSR1 Q6W5P4 2/20 0.53
HSD17B10 Q99714 1/20 0.53
MAPK1 P28482 2/20 0.48
TDP1 Q9NUW8 1/20 0.48
LMNA P02545 2/20 0.47
TSHR P16473 2/20 0.47
USP2 O75604 1/20 0.47
POLB P06746 1/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
TP53 P04637 2/20 0.45
THRB P10828 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
KDM4E B2RXH2 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
SCHEMBL2643398 0.87 UBE2M (0.47) HRH1ALDH1A1GAASMN1; SMN2HPGD
SCHEMBL1619375 0.84 SMN1; SMN2 (0.53) HRH1ALDH1A1GAASMN1; SMN2HPGD
SCHEMBL2644225 0.82 KDM4E (0.54) ALDH1A1GAASMN1; SMN2NPSR1POLB
SCHEMBL2645468 0.78 MEN1 (0.51) ALDH1A1GAAHPGDNPSR1MAPK1
SCHEMBL2643716 0.77 ALDH1A1 (0.52) ALDH1A1GAASMN1; SMN2NPSR1LMNA
SCHEMBL1619301 0.76 CYP1A2 (0.54) ALDH1A1GAASMN1; SMN2HPGDNPSR1
SCHEMBL1619125 0.76 NPC1 (0.47) HRH1ALDH1A1GAASMN1; SMN2HPGD
SCHEMBL2643494 0.74 GAA (0.48) ALDH1A1GAASMN1; SMN2NPSR1MAPK1
SCHEMBL1619278 0.74 MEN1 (0.49) ALDH1A1SMN1; SMN2NPSR1MAPK1TDP1
SCHEMBL1617928 0.74 SMN1; SMN2 (0.44) ALDH1A1GAASMN1; SMN2HPGDNPSR1

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 9 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-8796313-B2 Substituted dihydroisoindolones as allosteric modulators of glucokinase JANSSEN PHARMACEUTICA N.V. (BE) 2014-08-05 US disclosed
US-8796313-B2 Substituted dihydroisoindolones as allosteric modulators of glucokinase JANSSEN PHARMACEUTICA N.V. (BE) 2014-08-05 US disclosed
CN-101316836-A Substituted dihydroisoindolones as allosteric modulators of glucokinase JANSSEN PHARMACEUTICA NV (BE) 2008-12-03 CN disclosed
EP-1960385-A1 SUBSTITUTED DIHYDROISOINDOLONES AS ALLOSTERIC MODULATORS OF GLUCOKINASE JANSSEN PHARMACEUTICA N.V. (BE) 2008-08-27 EP disclosed
WO-2007053503-A1 SUBSTITUTED DIHYDROISOINDOLONES AS ALLOSTERIC MODULATORS OF GLUCOKINASE JANSSEN PHARMACEUTICA N.V. (BE) 2007-05-10 WO disclosed
US-20070099930-A1 Substituted Dihydroisoindolones As Allosteric Modulators of Glucokinase JANSSEN PHARMACEUTICA N.V. (BE) 2007-05-03 US disclosed
US-20070099930-A1 Substituted Dihydroisoindolones As Allosteric Modulators of Glucokinase JANSSEN PHARMACEUTICA N.V. (BE) 2007-05-03 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 HRH1 4051/4885ALDH1A1 1552/4885GAA 236/4885

“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.