SCHEMBL17345667

SCHEMBL17345667

O=C(CCc1nc2ccccc2[nH]1)NCC(O)CN1Cc2ccccc2C1

nearest known ligand 0.87

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 15/20 0.87
WDR77 Q9BQA1 15/20 0.87
KDM4E B2RXH2 1/20 0.54
MAPK1 P28482 1/20 0.53
GAA P10253 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.51

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
SCHEMBL15824151 0.93 PRMT5 (1.00) PRMT5WDR77MAPK1
SCHEMBL15917744 0.93 PRMT5 (1.00) PRMT5WDR77MAPK1
SCHEMBL15826024 0.93 PRMT5 (1.00) PRMT5WDR77MAPK1
SCHEMBL17300963 0.87 PRMT5 (0.76) PRMT5WDR77KDM4EMAPK1GAA
SCHEMBL17300943 0.83 PRMT5 (0.88) PRMT5WDR77
SCHEMBL17300931 0.83 PRMT5 (0.88) PRMT5WDR77
SCHEMBL17300927 0.83 PRMT5 (0.88) PRMT5WDR77
SCHEMBL17300928 0.83 PRMT5 (0.88) PRMT5WDR77
SCHEMBL19957633 0.83 PRMT5 (0.88) PRMT5WDR77
SCHEMBL17300940 0.83 PRMT5 (0.88) PRMT5WDR77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10479997-B2 Compositions and methods for diagnosis and treatment of prostate cancer NOVARTIS AG (CH) 2019-11-19 US disclosed
EP-2935247-B1 PRMT5 INHIBITORS AND USES THEREOF EPIZYME INC (US) 2019-08-28 EP disclosed
US-20170283807-A1 COMPOSITIONS AND METHODS FOR DIAGNOSIS AND TREATMENT OF PROSTATE CANCER NOVARTIS AG (CH) 2017-10-05 US disclosed
WO-2016089883-A1 COMPOSITIONS AND METHODS FOR DIAGNOSIS AND TREATMENT OF PROSTATE CANCER NOVARTIS AG (CH) 2016-06-09 WO disclosed
US-20150361042-A1 PRMT5 INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2015-12-17 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 (3 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-10479997-B2 Compositions and methods for diagnosis and treatment of prostate cancer PRMT5, PRMT1, PRMT3 PRMT5 1/4885WDR77 50/4885KDM4E 94/4885
US-20150361042-A1 PRMT5 INHIBITORS AND USES THEREOF PRMT5, PRMT1, PRMT6 PRMT5 1/4885WDR77 54/4885KDM4E 33/4885
US-20170283807-A1 COMPOSITIONS AND METHODS FOR DIAGNOSIS AND TREATMENT OF PROSTATE CANCER PRMT5, PRMT1, PRMT3 PRMT5 1/4885WDR77 50/4885KDM4E 94/4885

“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.