SCHEMBL4694820

SCHEMBL4694820

CC(=O)c1ccc(-c2cnn3ccc(NCCO)nc23)s1

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 10/20 0.53
RET P07949 9/20 0.49
PIM2 Q9P1W9 4/20 0.41
CAMK2D Q13557 1/20 0.40

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
SCHEMBL4337317 0.89 RET (0.61) PIM1RETPIM2
SCHEMBL4331218 0.81 RET (0.61) PIM1RET
SCHEMBL4558405 0.78 FYN (0.56) PIM1RET
SCHEMBL4340361 0.76 FYN (0.46) PIM1RETPIM2
SCHEMBL4335443 0.76 RET (0.53) PIM1RETPIM2
SCHEMBL4332790 0.75 FYN (0.45) PIM1RET
SCHEMBL4337307 0.73 RET (0.67) PIM1RETPIM2
SCHEMBL4331224 0.72 PIM1 (0.74) PIM1RETPIM2
SCHEMBL4693637 0.72 RET (0.73) PIM1RETPIM2
SCHEMBL4331386 0.72 RET (0.62) PIM1RETPIM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1900739-A1 Diazolodiazine derivatives as kinase inhibitors CELLZOME AG (DE) 2008-03-19 EP claimed
WO-2008025822-A1 DIAZOLODIAZINE DERIVATIVES AS KINASE INHIBITORS CELLZOME LIMITED (GB) 2008-03-06 WO claimed
EP-1900739-A1 Diazolodiazine derivatives as kinase inhibitors CELLZOME AG (DE) 2008-03-19 EP disclosed
WO-2008025822-A1 DIAZOLODIAZINE DERIVATIVES AS KINASE INHIBITORS CELLZOME LIMITED (GB) 2008-03-06 WO disclosed