SCHEMBL13367759

SCHEMBL13367759

Cc1ccc2c(c1)oc(=O)n2CC1CC1

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MIF P14174 3/20 0.58
CD74 P04233 1/20 0.48
PTGS2 P35354 3/20 0.47
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
POLB P06746 1/20 0.47
ALDH1A1 P00352 1/20 0.45

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
SCHEMBL16948413 0.90 MIF (0.59) MIFCD74KMT2AMEN1POLB
SCHEMBL13962153 0.82 MIF (0.39) MIF
SCHEMBL30615684 0.82 NPC1 (0.58) KMT2AALDH1A1
SCHEMBL28500980 0.82 NPC1 (0.58) KMT2AALDH1A1
SCHEMBL24973917 0.82 MIF (0.54) MIFCD74KMT2AMEN1POLB
SCHEMBL13341017 0.82 PPARG (0.46) MIFPOLB
SCHEMBL13367743 0.80 MIF (0.66) MIFCD74PTGS2KMT2AMEN1
SCHEMBL30195005 0.78 TSHR (0.64) MIFALDH1A1
SCHEMBL17766397 0.78 KMO (0.41) MIFCD74
SCHEMBL14518249 0.76 MIF (0.65) MIFCD74PTGS2KMT2AMEN1

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 MIF 4047/4885CD74 3972/4885PTGS2 2095/4885

“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.