SCHEMBL1015989

SCHEMBL1015989

CC1(c2nc(O)ncc2C(=O)NC2C3CC4CC2CC(OCc2ccccc2)(C4)C3)CC1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 12/20 0.48
IDH1 O75874 4/20 0.42
FAAH O00519 1/20 0.38
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
EPHX2 P34913 2/20 0.37

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
SCHEMBL1018187 0.90 HSD11B1 (0.47) HSD11B1IDH1
SCHEMBL1014764 0.89 HSD11B1 (0.46) HSD11B1IDH1
SCHEMBL1015663 0.85 HSD11B1 (0.71) HSD11B1IDH1
SCHEMBL1012588 0.75 EPHX2 (0.42) HSD11B1IDH1FAAHCNR1CNR2
SCHEMBL1013188 0.70 HSD11B1 (0.67) HSD11B1
SCHEMBL1013189 0.70 HSD11B1 (0.67) HSD11B1
SCHEMBL12887783 0.68 CPB1 (0.46) HSD11B1EPHX2
SCHEMBL1013882 0.68 EPHX2 (0.45) HSD11B1IDH1FAAHCNR1CNR2
SCHEMBL1018743 0.68 EPHX2 (0.45) HSD11B1IDH1FAAHCNR1CNR2
SCHEMBL13667475 0.68 EPHX2 (0.41) HSD11B1IDH1FAAHCNR1CNR2

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
EP-2271629-A1 SUBSTITUTED PYRIMIDIN-5-CARBOXAMIDES 281 AstraZeneca AB (SE) 2011-01-12 EP disclosed
WO-2009130496-A1 SUBSTITUTED PYRIMIDIN-5-CARBOXAMIDES 281 ASTRAZENECA AB (SE) 2009-10-29 WO disclosed
US-20090264401-A1 SUBSTITUTED PYRIMIDIN-5-CARBOXAMIDES 281 ASTRAZENECA AB (SE) 2009-10-22 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-20090264401-A1 SUBSTITUTED PYRIMIDIN-5-CARBOXAMIDES 281 CYP2S1, HSD11B1, HSD3B1 HSD11B1 2/4885IDH1 159/4885FAAH 253/4885

“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.