SCHEMBL18830127

SCHEMBL18830127

CCN(c1cc(C(F)(F)F)cc(C(=O)OC)c1C)C1CCCCC1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EZH2 Q15910 9/20 0.49
NOTUM Q6P988 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
CFTR P13569 1/20 0.37
MAPT P10636 2/20 0.37
MCHR1 Q99705 1/20 0.37
GAA P10253 1/20 0.37
ATM Q13315 1/20 0.37
ALDH1A1 P00352 3/20 0.36
KDM4E B2RXH2 2/20 0.36
NPC1 O15118 1/20 0.36
POLB P06746 1/20 0.36
RAB9A P51151 1/20 0.36
TSHR P16473 1/20 0.36
HSD17B10 Q99714 1/20 0.36
HSD11B1 P28845 1/20 0.35

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
SCHEMBL13280013 0.89 EZH2 (0.50) EZH2NOTUMCFTR
SCHEMBL13280200 0.88 EZH2 (0.47) EZH2NOTUMATM
SCHEMBL13279911 0.86 EZH2 (0.49) EZH2NOTUMKMT2ACFTRALDH1A1
SCHEMBL13280278 0.86 EZH2 (0.46) EZH2NOTUMCFTR
SCHEMBL17004067 0.86 EZH2 (0.46) EZH2NOTUMKMT2A
SCHEMBL18830061 0.86 EZH2 (0.40) EZH2MEN1KMT2AGAAALDH1A1
SCHEMBL15731229 0.85 EZH2 (0.44) EZH2NOTUMMEN1KMT2ACFTR
SCHEMBL13280898 0.85 EZH2 (0.44) EZH2NOTUMKMT2ACFTRALDH1A1
SCHEMBL15731228 0.85 EZH2 (0.44) EZH2NOTUMMEN1KMT2ACFTR
SCHEMBL13280264 0.85 EZH2 (0.47) EZH2MEN1KMT2AGAAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3470396-A1 SUBSTITUTED BENZENE COMPOUNDS Epizyme, Inc. (US) 2019-04-17 EP disclosed
EP-3165520-A1 SUBSTITUTED BENZENE COMPOUNDS Epizyme Inc (US) 2017-05-10 EP disclosed
US-20140142083-A1 Substituted Benzene Compounds Epizyme, Inc. (US) 2014-05-22 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-20140142083-A1 Substituted Benzene Compounds CYP1B1, TP53, VHL EZH2 2519/4885NOTUM 478/4885MEN1 2339/4885

“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.