SCHEMBL13340920

SCHEMBL13340920

CC(C)c1ccc2c(c1)oc(=O)n2CC(N)=O

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.59
TP53 P04637 3/20 0.53
POLB P06746 1/20 0.53
MAPT P10636 1/20 0.53
SMN1; SMN2 Q16637 3/20 0.48
MAPK1 P28482 1/20 0.44
CBX7 O95931 3/20 0.43
CDYL Q9Y232 3/20 0.43
CDY1; CDY1B Q9Y6F8 3/20 0.43
CDYL2 Q8N8U2 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL16601597 0.82 HPGD (0.64) HPGDTP53SMN1; SMN2MAPK1MEN1
SCHEMBL13340922 0.81 SMN1; SMN2 (0.51) HPGDTP53POLBMAPTSMN1; SMN2
SCHEMBL4413144 0.79 HPGD (0.64) HPGDTP53POLBSMN1; SMN2MAPK1
SCHEMBL4414360 0.79 HPGD (0.64) HPGDTP53POLBMAPTMEN1
SCHEMBL4411794 0.79 HPGD (0.64) HPGDTP53SMN1; SMN2MAPK1CBX7
SCHEMBL4413088 0.78 HPGD (0.59) HPGDTP53POLBSMN1; SMN2CBX7
SCHEMBL13341138 0.78 POLB (0.44) TP53POLBMAPTSMN1; SMN2MAPK1
SCHEMBL13341017 0.76 PPARG (0.46) TP53POLBMAPTSMN1; SMN2
SCHEMBL4414345 0.75 HPGD (1.00) HPGDPOLBMAPTSMN1; SMN2MAPK1
SCHEMBL16250472 0.73 HPGD (0.64) HPGDPOLBSMN1; SMN2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8993585-B2 Cyclic amine substituted pyrimidinediamines as PKC inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2015-03-31 US disclosed
US-20100130486-A1 CYCLIC AMINE SUBSTITUTED PYRIMIDINEDIAMINES AS PKC INHIBITORS RIGEL PHARMACEUTICALS, INC. 2010-05-27 US disclosed
US-20100130486-A1 CYCLIC AMINE SUBSTITUTED PYRIMIDINEDIAMINES AS PKC INHIBITORS RIGEL PHARMACEUTICALS, INC. 2010-05-27 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-20100130486-A1 CYCLIC AMINE SUBSTITUTED PYRIMIDINEDIAMINES AS PKC INHIBITORS PRKCH, PKD2, PRKCQ HPGD 1434/4885TP53 1863/4885POLB 955/4885

“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.