SCHEMBL2644568

SCHEMBL2644568

CNC(=O)NC(=O)CSC1C(C)=C(C)C(=O)N1Cc1ccc(OC)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
TSHR P16473 1/20 0.39
KDM4E B2RXH2 2/20 0.38
HKDC1 Q2TB90 1/20 0.38
MAPT P10636 2/20 0.38
HTT P42858 2/20 0.38
POLB P06746 1/20 0.38
GAA P10253 1/20 0.38
SIGMAR1 Q99720 1/20 0.38
CMA1 P23946 1/20 0.37
SAE1 Q9UBE0 1/20 0.37
UBA2 Q9UBT2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
PKM P14618 1/20 0.37
CYP2C19 P33261 1/20 0.37
MAPK1 P28482 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
SCHEMBL2643558 0.84 MEN1 (0.53) MEN1KMT2ATSHRKDM4EHKDC1
SCHEMBL2644277 0.79 ALDH1A1 (0.48) MEN1KMT2AKDM4EHKDC1MAPT
SCHEMBL2643472 0.79 RAB9A (0.45) MEN1KMT2ATSHRKDM4EHTT
SCHEMBL2643616 0.79 ALDH1A1 (0.48) MEN1KMT2ATSHRKDM4EMAPT
SCHEMBL2643266 0.78 ALDH1A1 (0.59) MEN1KMT2AKDM4EMAPTHTT
SCHEMBL2643579 0.78 KDM4E (0.46) MEN1KMT2AKDM4EHKDC1MAPT
SCHEMBL2643492 0.78 ALDH1A1 (0.53) MEN1KMT2ATSHRKDM4EMAPT
SCHEMBL2643069 0.78 NPC1 (0.53) MEN1KMT2ATSHRMAPTHTT
SCHEMBL2644216 0.77 TSHR (0.41) MEN1KMT2ATSHRKDM4EMAPT
SCHEMBL2643673 0.77 MAPK10 (0.47) MEN1KMT2AKDM4EHKDC1POLB

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-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

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 MEN1 4513/4885KMT2A 3063/4885TSHR 3038/4885

“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.