SCHEMBL3797936

SCHEMBL3797936

Cc1sc2ncnc(Nc3ccccc3OC(C)C)c2c1C

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 4/20 0.60
MAPT P10636 3/20 0.60
HTT P42858 2/20 0.60
HPGD P15428 1/20 0.60
MKNK2 Q9HBH9 11/20 0.57
MKNK1 Q9BUB5 6/20 0.57
RAF1 P04049 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
GAA P10253 1/20 0.51
ALDH1A1 P00352 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
MRGPRX1 Q96LB2 1/20 0.49
PIP4K2C Q8TBX8 1/20 0.47

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
SCHEMBL3796892 0.91 MAPK1 (0.57) MAPK1MAPTHTTHPGDMKNK2
SCHEMBL3801219 0.89 MAPK1 (0.58) MAPK1MAPTHTTHPGDMKNK2
SCHEMBL3793908 0.89 MAPK1 (0.55) MAPK1MAPTHTTHPGDMKNK2
SCHEMBL3804696 0.87 MAPK1 (0.53) MAPK1MAPTHTTHPGDMKNK2
SCHEMBL3804302 0.86 MAPT (0.64) MAPK1MAPTHTTHPGDRAF1
SCHEMBL3794234 0.86 MKNK2 (0.75) MKNK2MKNK1
SCHEMBL3797070 0.86 MAPK1 (0.57) MAPK1MAPTHTTHPGDMKNK2
SCHEMBL3804634 0.85 MKNK2 (0.50) MAPK1MAPTHTTHPGDMKNK2
SCHEMBL3799998 0.84 MAPK1 (0.61) MAPK1MAPTHTTHPGDMKNK2
SCHEMBL3803487 0.83 MAPK1 (0.63) MAPK1MAPTHTTHPGDRAF1

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100143341-A1 THIENOPYRIMIDINES FOR PHARMACEUTICAL COMPOSITIONS DEVELOGEN AKTIENGESELLSCHAFT (DE) 2010-06-10 US claimed
EP-1899353-A1 THIENOPYRIMIDINES FOR PHARMACEUTICAL COMPOSITIONS DeveloGen Aktiengesellschaft (DE) 2008-03-19 EP claimed
WO-2007059905-A9 THIENOPYRIMIDINES TREATING INFLAMMATORY DISEASES DEVELOGEN AG (DE) 2007-11-01 WO claimed
WO-2007059905-A2 THIENOPYRIMIDINES TREATING INFLAMMATORY DISEASES DEVELOGEN AKTIENGESELLSCHAFT (DE) 2007-05-31 WO claimed
WO-2006136402-A1 THIENOPYRIMIDINES FOR PHARMACEUTICAL COMPOSITIONS DEVELOGEN AKTIENGESELLSCHAFT (DE) 2006-12-28 WO claimed
US-20100143341-A1 THIENOPYRIMIDINES FOR PHARMACEUTICAL COMPOSITIONS DEVELOGEN AKTIENGESELLSCHAFT (DE) 2010-06-10 US disclosed
EP-1899353-A1 THIENOPYRIMIDINES FOR PHARMACEUTICAL COMPOSITIONS DeveloGen Aktiengesellschaft (DE) 2008-03-19 EP disclosed
WO-2007059905-A9 THIENOPYRIMIDINES TREATING INFLAMMATORY DISEASES DEVELOGEN AG (DE) 2007-11-01 WO disclosed
WO-2007059905-A2 THIENOPYRIMIDINES TREATING INFLAMMATORY DISEASES DEVELOGEN AKTIENGESELLSCHAFT (DE) 2007-05-31 WO disclosed
WO-2006136402-A1 THIENOPYRIMIDINES FOR PHARMACEUTICAL COMPOSITIONS DEVELOGEN AKTIENGESELLSCHAFT (DE) 2006-12-28 WO 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-20100143341-A1 THIENOPYRIMIDINES FOR PHARMACEUTICAL COMPOSITIONS DTYMK, CMPK1, PDXK MAPK1 573/4885MAPT 2500/4885HTT 3454/4885

“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.