SCHEMBL9896583

SCHEMBL9896583

Cc1ccc(OCC2CC2)c(-c2ncnc3c(C(=O)N[C@@H]4CC[C@@H](NC(=O)CO)C[C@@H]4C)c(C)[nH]c23)c1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM2B Q8NHM5 1/20 0.33
KDM4C Q9H3R0 1/20 0.33
CNR2 P34972 2/20 0.33
LMNA P02545 1/20 0.32
HPGD P15428 1/20 0.32
BRD4 O60885 1/20 0.31
HTT P42858 1/20 0.30
CNR1 P21554 1/20 0.30
SMO Q99835 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
SCHEMBL9896032 1.00 KDM2B (0.33) KDM2BKDM4CCNR2LMNAHPGD
SCHEMBL9896582 1.00 KDM2B (0.33) KDM2BKDM4CCNR2LMNAHPGD
SCHEMBL9896033 1.00 KDM2B (0.33) KDM2BKDM4CCNR2LMNAHPGD
SCHEMBL9897836 1.00 KDM2B (0.33) KDM2BKDM4CCNR2LMNAHPGD
SCHEMBL9899390 1.00 KDM2B (0.33) KDM2BKDM4CCNR2LMNAHPGD
SCHEMBL9897993 0.97 KDM2B (0.33) KDM2BKDM4CCNR2LMNAHPGD
SCHEMBL9896413 0.97 KDM2B (0.33) KDM2BKDM4CCNR2LMNAHPGD
SCHEMBL9895617 0.97 KDM2B (0.33) KDM2BKDM4CCNR2LMNAHPGD
SCHEMBL9895616 0.97 KDM2B (0.33) KDM2BKDM4CCNR2LMNAHPGD
SCHEMBL9897008 0.97 KDM2B (0.33) KDM2BKDM4CCNR2LMNAHPGD

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-8927557-B2 Methylpyrrolopyrimidinecarboxamides TAKEDA GMBH (DE) 2015-01-06 US disclosed
EP-2470536-B1 Methylpyrrolopyrimidinecarboxamides TAKEDA GMBH (DE) 2014-11-12 EP disclosed
US-20120149721-A1 METHYLPYRROLOPYRIMIDINECARBOXAMIDES NYCOMED GMBH (DE) 2012-06-14 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-20120149721-A1 METHYLPYRROLOPYRIMIDINECARBOXAMIDES PDE5A, PDE12, PDE4A KDM2B 326/4885KDM4C 161/4885CNR2 2377/4885

“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.