SCHEMBL1045241

SCHEMBL1045241

CC1CCO1.COc1ccc(CC2CNC(=O)N2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.51
PDE4A P27815 2/20 0.51
PDE4B Q07343 2/20 0.51
PDE4D Q08499 2/20 0.51
LMNA P02545 2/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
TNF P01375 1/20 0.51
MAPT P10636 1/20 0.51
PDE4C Q08493 1/20 0.51
PDE3B Q13370 1/20 0.51
PDE3A Q14432 1/20 0.51
KDM4E B2RXH2 1/20 0.51
CYP1A2 P05177 1/20 0.51
CYP3A4 P08684 1/20 0.51
NFKB1 P19838 1/20 0.51
GLA P06280 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
TACR2 P21452 1/20 0.40
GRM2 Q14416 1/20 0.38

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
SCHEMBL27945102 0.88 KMT2A (0.49) MAPK1PDE4APDE4BPDE4DLMNA
SCHEMBL2847339 0.74 MAPK1 (0.42) MAPK1PDE4APDE4BPDE4DLMNA
SCHEMBL25366278 0.73 MAPK1 (0.41) MAPK1PDE4APDE4BPDE4DLMNA
SCHEMBL25366273 0.73 MAPK1 (0.41) MAPK1PDE4APDE4BPDE4DLMNA
SCHEMBL11556653 0.72 PDE4A (0.77) MAPK1PDE4APDE4BPDE4DLMNA
SCHEMBL27916057 0.70 PDE4A (0.47) MAPK1PDE4APDE4BPDE4DLMNA
SCHEMBL410596 0.70 MEN1 (0.47) MAPK1PDE4APDE4BPDE4DLMNA
SCHEMBL5496563 0.70 MEN1 (0.47) MAPK1PDE4APDE4BPDE4DLMNA
SCHEMBL21678055 0.70 CYP2D6 (0.49) MAPK1LMNAMEN1KMT2ACYP2D6
SCHEMBL11321860 0.69 CYP3A4 (0.65) MAPK1PDE4APDE4BPDE4DLMNA

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-7872101-B1 Modulators of the orphan G protein-coupled receptors GPR78 and GPR26 SCHERING CORPORATION (US) 2011-01-18 US disclosed
US-20070270433-A1 Thiazolo-pyrimidine/pyridine urea derivatives BRINKMAN JOHN A 2007-11-22 US disclosed
US-20050009847-A1 Compounds and methods for increasing neurogenesis NEURONOVA AB (COMPANY REGISTRATION NO. 556703-0118) (SE) 2005-01-13 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-20070270433-A1 Thiazolo-pyrimidine/pyridine urea derivatives ADORA2B, UTS2R, TBXA2R MAPK1 1615/4885PDE4A 34/4885PDE4B 25/4885

“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.