SCHEMBL20829977

SCHEMBL20829977

C=Cc1ccnnc1NC

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ACVR2A P27037 1/20 0.33
TGFBR1 P36897 1/20 0.33
ALDH1A1 P00352 1/20 0.30
TRIM58 Q8NG06 1/20 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
SCHEMBL25487680 0.80 ALDH1A1 (0.30) ALDH1A1
SCHEMBL21284326 0.73 KDM4E (0.36) ACVR2ATGFBR1ALDH1A1TRIM58
SCHEMBL14012369 0.72
SCHEMBL872385 0.70 ALDH1A1 (0.30) ALDH1A1
SCHEMBL18869729 0.70 POLB (0.32)
SCHEMBL25487682 0.68 TDP1 (0.42) ALDH1A1TRIM58
SCHEMBL28954619 0.68
SCHEMBL7640865 0.67 CALM1 (0.37) ALDH1A1
SCHEMBL21939041 0.67 APLNR (0.31)
SCHEMBL19477494 0.67 ALDH1A1 (0.38) ACVR2ATGFBR1ALDH1A1TRIM58

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190083482-A1 PRMT5 INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2019-03-21 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-20190083482-A1 PRMT5 INHIBITORS AND USES THEREOF PRMT5, PRMT1, PRMT6 ACVR2A 4270/4885TGFBR1 2484/4885ALDH1A1 2460/4885

“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.