SCHEMBL16201388

SCHEMBL16201388

CCCN(C)Cc1c[nH]nc1-c1cccc(Cl)c1F

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CFD P00746 1/20 0.34
MAPK10 P53779 1/20 0.34
MAPK14 Q16539 1/20 0.34
KDM4E B2RXH2 1/20 0.33
LMNA P02545 1/20 0.33
UTRN P46939 1/20 0.32
CARM1 Q86X55 2/20 0.32
HPGD P15428 1/20 0.32
CRHR1 P34998 1/20 0.32
PTPN11 Q06124 2/20 0.31
AKR1B1 P15121 1/20 0.31
PRMT3 O60678 1/20 0.31
PRMT6 Q96LA8 1/20 0.31
PRMT8 Q9NR22 1/20 0.31
RECQL P46063 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
KRAS P01116 1/20 0.31
EGFR P00533 1/20 0.31
GRIN2B Q13224 2/20 0.30

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
SCHEMBL16201216 0.89 CARM1 (0.43) CFDMAPK10MAPK14KDM4ELMNA
SCHEMBL16201381 0.88 CRHR1 (0.41) KDM4ELMNACARM1CRHR1PRMT3
SCHEMBL16201351 0.83 LMNA (0.44) KDM4ELMNARECQLTDP1
SCHEMBL16201385 0.82 LMNA (0.38) KDM4ELMNACARM1PRMT3PRMT6
SCHEMBL16201367 0.81 ALDH1A1 (0.35) KDM4ECARM1TDP1
SCHEMBL16201348 0.81 NISCH (0.36) KDM4ECARM1CRHR1TDP1
SCHEMBL16201406 0.80 TDP1 (0.34) KDM4ELMNACARM1CRHR1RECQL
SCHEMBL16201417 0.79 MEN1 (0.39) KDM4ELMNATDP1
SCHEMBL16201399 0.79 SLC6A2 (0.35) KDM4ELMNACRHR1RECQLTDP1
SCHEMBL16201352 0.78 CRHR1 (0.43) CRHR1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9776972-B2 Pyrazole derivatives as arginine methyltransferase inhibitors and uses thereof EPIZYME INC. (US) 2017-10-03 US disclosed
US-9346761-B2 Arginine methyltransferase inhibitors and uses thereof Epizyme, Inc. (US) 2016-05-24 US disclosed
US-20160137609-A1 PYRAZOLE DERIVATIVES AS ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2016-05-19 US disclosed
US-20140323537-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2014-10-30 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 (2 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-20140323537-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF PRMT1, PRMT3, PRMT5 CFD 4864/4885MAPK10 1973/4885MAPK14 2928/4885
US-20160137609-A1 PYRAZOLE DERIVATIVES AS ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF PRMT1, PRMT3, PRMT5 CFD 4877/4885MAPK10 2466/4885MAPK14 2281/4885

“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.