SCHEMBL21033955

SCHEMBL21033955

COC1CCc2nc(C(=O)O)cn2C1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 2/20 0.38
SCD5 Q86SK9 3/20 0.33
SCD O00767 2/20 0.33
HDAC2 Q92769 1/20 0.33
RXFP1 Q9HBX9 1/20 0.32
PRKAB2 O43741 2/20 0.31
PRKAG1 P54619 2/20 0.31
PRKAA2 P54646 2/20 0.31
PRKAA1 Q13131 2/20 0.31
PRKAG3 Q9UGI9 2/20 0.31
PRKAG2 Q9UGJ0 2/20 0.31
PRKAB1 Q9Y478 2/20 0.31
CCNC P24863 1/20 0.30
CDK8 P49336 1/20 0.30
SPR P35270 1/20 0.30
GPR35 Q9HC97 1/20 0.30
ALOX15 P16050 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
SCHEMBL21033475 0.83 GAA (0.40) RXFP1
SCHEMBL21033178 0.81 RIPK1 (0.37) RIPK1HDAC2RXFP1
SCHEMBL29852659 0.81 LMNA (0.36) HDAC2
SCHEMBL23645389 0.79 TTR (0.37) HDAC2SPR
SCHEMBL21033242 0.78 HDAC2 (0.34) HDAC2RXFP1
SCHEMBL26299381 0.77 RIPK1 (0.32) RIPK1
SCHEMBL21033532 0.77 HDAC2 (0.33) RIPK1HDAC2
SCHEMBL21570164 0.77 RIPK1 (0.34) RIPK1SCD5SCDGPR35ALOX15
SCHEMBL21014288 0.75 RIPK1 (0.33) RIPK1HDAC2RXFP1
SCHEMBL3660427 0.75 KDM4E (0.35) HDAC2RXFP1GPR35

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210371431-A1 HETEROCYCLIC COMPOUNDS AS PRMT5 INHIBITORS JUBILANT EPISCRIBE LLC 2021-12-02 US disclosed
WO-2019102494-A1 HETEROCYCLIC COMPOUNDS AS PRMT5 INHIBITORS JUBILANT BIOSYS LIMITED (IN) 2019-05-31 WO 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-20210371431-A1 HETEROCYCLIC COMPOUNDS AS PRMT5 INHIBITORS PRMT5, PRMT1, PRMT3 RIPK1 1050/4885SCD5 522/4885SCD 3260/4885

“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.