SCHEMBL2643986

SCHEMBL2643986

CCOC(=O)C=Cc1ccc(NC(=O)CCC2c3c(F)cccc3C(=O)N2Cc2ccc(F)cc2)nc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.41
TSHR P16473 1/20 0.39
ALDH1A1 P00352 4/20 0.39
MAPT P10636 4/20 0.39
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
LMNA P02545 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
POLB P06746 2/20 0.37
CYP3A4 P08684 2/20 0.37
CYP2C9 P11712 2/20 0.37
HDAC1 Q13547 1/20 0.36
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
IDO1 P14902 1/20 0.34
TDO2 P48775 1/20 0.34
CYP1A2 P05177 1/20 0.34

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
SCHEMBL2643760 0.83 WNT3A (0.42) KDM4EALDH1A1MAPTNPC1SMN1; SMN2
SCHEMBL2644875 0.83 SMN1; SMN2 (0.47) KDM4ETSHRALDH1A1MAPTLMNA
SCHEMBL2643419 0.83 TSHR (0.41) KDM4ETSHRALDH1A1MAPTNPC1
SCHEMBL2643521 0.83 TSHR (0.41) KDM4ETSHRALDH1A1MAPTNPC1
SCHEMBL2643416 0.83 TSHR (0.41) KDM4ETSHRALDH1A1MAPTNPC1
SCHEMBL2644105 0.83 MAPT (0.46) KDM4ETSHRALDH1A1MAPTLMNA
SCHEMBL2643847 0.83 MEN1 (0.47) TSHRALDH1A1MAPTMEN1KMT2A
SCHEMBL2663880 0.83 HTT (0.49) KDM4EALDH1A1MEN1KMT2ACYP3A4
SCHEMBL2643590 0.82 MAPT (0.40) KDM4ETSHRALDH1A1MAPTPOLB
SCHEMBL2643593 0.82 MAPT (0.40) KDM4ETSHRALDH1A1MAPTPOLB

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 KDM4E 1206/4885TSHR 3340/4885ALDH1A1 1552/4885

“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.