SCHEMBL2643673

SCHEMBL2643673

CCc1ccnc(NC(=O)CSC2C(C)=C(C)C(=O)N2Cc2ccc(OC)cc2)c1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPK10 P53779 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
ALDH1A1 P00352 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
NR3C2 P08235 1/20 0.45
RIOK2 Q9BVS4 4/20 0.43
TP53 P04637 2/20 0.42
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
THRB P10828 1/20 0.39
CCR3 P51677 1/20 0.39
KDM4E B2RXH2 2/20 0.39
HKDC1 Q2TB90 1/20 0.39
GSK3A P49840 1/20 0.39
POLB P06746 2/20 0.39
WNT3A P56704 1/20 0.37

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
SCHEMBL2643266 0.91 ALDH1A1 (0.59) MAPK10SMN1; SMN2ALDH1A1L3MBTL1NR3C2
SCHEMBL2644277 0.86 ALDH1A1 (0.48) MAPK10SMN1; SMN2ALDH1A1L3MBTL1TP53
SCHEMBL2643579 0.85 KDM4E (0.46) MAPK10SMN1; SMN2ALDH1A1L3MBTL1TP53
SCHEMBL2643472 0.83 RAB9A (0.45) MAPK10SMN1; SMN2ALDH1A1L3MBTL1TP53
SCHEMBL2642709 0.82 MAPT (0.42) ALDH1A1L3MBTL1TP53KMT2AMEN1
SCHEMBL2643492 0.82 ALDH1A1 (0.53) SMN1; SMN2ALDH1A1L3MBTL1KMT2AMEN1
SCHEMBL2643223 0.81 KMT2A (0.49) SMN1; SMN2ALDH1A1L3MBTL1TP53KMT2A
SCHEMBL2643343 0.81 KMT2A (0.44) MAPK10SMN1; SMN2ALDH1A1L3MBTL1RIOK2
SCHEMBL2643616 0.81 ALDH1A1 (0.48) SMN1; SMN2ALDH1A1TP53KMT2AMEN1
SCHEMBL2644216 0.80 TSHR (0.41) ALDH1A1L3MBTL1TP53KMT2AMEN1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8680122-B2 Substituted pyrrolones as allosteric modulators of glucokinase JANSSEN PHARMACETICA N.V. (BE) 2014-03-25 US disclosed
US-8680122-B2 Substituted pyrrolones as allosteric modulators of glucokinase JANSSEN PHARMACETICA N.V. (BE) 2014-03-25 US disclosed
US-8680122-B2 Substituted pyrrolones as allosteric modulators of glucokinase JANSSEN PHARMACETICA N.V. (BE) 2014-03-25 US disclosed
US-20070099937-A1 Substituted Pyrrolones As Allosteric Modulators of Glucokinase JANSSEN PHARMACEUTICA N.V. (BE) 2007-05-03 US disclosed
US-20070099937-A1 Substituted Pyrrolones As Allosteric Modulators of Glucokinase JANSSEN PHARMACEUTICA N.V. (BE) 2007-05-03 US disclosed
US-20070099937-A1 Substituted Pyrrolones 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-20070099937-A1 Substituted Pyrrolones As Allosteric Modulators of Glucokinase GCK, GCKR, PDXK MAPK10 764/4885SMN1; SMN2 4546/4885ALDH1A1 2312/4885

“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.