SCHEMBL16201374

SCHEMBL16201374

CCCN(C)Cc1c[nH]nc1-c1ccc(OC)cc1F

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.48
KDM4E B2RXH2 3/20 0.47
AMY1A P0DUB6 2/20 0.36
CRHR1 P34998 2/20 0.35
PDGFRB P09619 1/20 0.35
GAA P10253 1/20 0.35
HTR6 P50406 1/20 0.35
CHRNA7 P36544 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
SCHEMBL16201198 0.91 ALDH1A1 (0.48) ALDH1A1KDM4EAMY1APDGFRBGAA
SCHEMBL16201405 0.87 CRHR1 (0.47) ALDH1A1KDM4ECRHR1HTR6
SCHEMBL16201359 0.87 CRHR1 (0.46) ALDH1A1KDM4ECRHR1GAA
SCHEMBL16201356 0.87 ALDH1A1 (0.41) ALDH1A1KDM4EGAA
SCHEMBL16201394 0.86 CRHR1 (0.40) ALDH1A1KDM4ECRHR1HTR6
SCHEMBL16201360 0.86 ALDH1A1 (0.36) ALDH1A1KDM4EGAA
SCHEMBL16201403 0.85 CRHR1 (0.41) ALDH1A1KDM4ECRHR1GAA
SCHEMBL16201399 0.85 SLC6A2 (0.35) ALDH1A1KDM4ECRHR1
SCHEMBL16201397 0.83 PRMT6 (0.41) ALDH1A1KDM4E
SCHEMBL16201351 0.82 LMNA (0.44) ALDH1A1KDM4EGAA

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 ALDH1A1 686/4885KDM4E 157/4885AMY1A 2985/4885
US-20160137609-A1 PYRAZOLE DERIVATIVES AS ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF PRMT1, PRMT3, PRMT5 ALDH1A1 895/4885KDM4E 288/4885AMY1A 3472/4885

“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.