SCHEMBL13340936

SCHEMBL13340936

CCN1C(=O)C(C)(C)Oc2cc(C(C)C)cnc21

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 1/20 0.35
USP2 O75604 1/20 0.33
MARK3 P27448 1/20 0.33
ELANE P08246 1/20 0.32
CTSG P08311 1/20 0.32
PRTN3 P24158 1/20 0.32
KMT2A Q03164 3/20 0.32
POLB P06746 2/20 0.32
ALDH1A1 P00352 2/20 0.32
MAPT P10636 1/20 0.32
RECQL P46063 1/20 0.32
MEN1 O00255 2/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL13341015 0.87 HDAC6 (0.36) HDAC6USP2ELANECTSGPRTN3
SCHEMBL13340902 0.85 MARK3 (0.30) MARK3
SCHEMBL13341081 0.85 HDAC6 (0.35) HDAC6USP2KMT2APOLB
SCHEMBL19954830 0.84 MAPT (0.36) HDAC6KMT2APOLBALDH1A1MAPT
SCHEMBL13341013 0.84 REN (0.36) HDAC6USP2KMT2APOLBALDH1A1
SCHEMBL16601578 0.83 MAPT (0.35) HDAC6USP2MARK3ELANECTSG
SCHEMBL13960944 0.82 HDAC6 (0.33) HDAC6USP2MARK3ELANECTSG
SCHEMBL13340933 0.82 LMNA (0.40)
SCHEMBL13340916 0.77 SLC9A1 (0.39) USP2ELANECTSGPRTN3KMT2A
SCHEMBL13367748 0.76 REN (0.36) HDAC6USP2KMT2APOLBALDH1A1

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-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

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 HDAC6 1916/4885USP2 4763/4885MARK3 303/4885

“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.