SCHEMBL3793705

SCHEMBL3793705

COc1cc(N2CCC(N3CCN(C)CC3)CC2)ccc1Nc1ncc(-c2ccc3[nH]ncc3c2)c(N)n1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDGFRB P09619 2/20 0.63
▸ PDGFRA P16234 2/20 0.63
▸ EGFR P00533 4/20 0.57
▸ INSR P06213 12/20 0.56
▸ IGF1R P08069 12/20 0.56
▸ ALK Q9UM73 12/20 0.56
▸ LRRK2 Q5S007 3/20 0.55
▸ MAPK7 Q13164 1/20 0.55
▸ DCLK1 O15075 1/20 0.52
▸ PTK2 Q05397 2/20 0.51
▸ CHEK1 O14757 1/20 0.51
▸ AURKA O14965 1/20 0.51
▸ NUAK1 O60285 1/20 0.51
▸ JAK2 O60674 1/20 0.51
▸ STK10 O94804 1/20 0.51
▸ PRKD3 O94806 1/20 0.51
▸ SLC34A2 O95436 1/20 0.51
▸ CHEK2 O96017 1/20 0.51
▸ ABL1 P00519 1/20 0.51
▸ CD74 P04233 1/20 0.51

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
SCHEMBL3764374 0.81 PDGFRB (0.75) PDGFRBPDGFRAEGFRINSRIGF1R
SCHEMBL24327435 0.81 ALK (0.77) PDGFRBPDGFRAEGFRINSRIGF1R
SCHEMBL30378262 0.81 ALK (0.77) PDGFRBPDGFRAEGFRINSRIGF1R
SCHEMBL26395575 0.78 PDGFRB (1.00) PDGFRBPDGFRAEGFRINSRIGF1R
SCHEMBL29793855 0.78 PDGFRB (1.00) PDGFRBPDGFRAEGFRINSRIGF1R
SCHEMBL30003588 0.77 INSR (0.65) PDGFRBPDGFRAEGFRINSRIGF1R
SCHEMBL5282767 0.76 ALK (0.56) EGFRINSRIGF1RALKLRRK2
SCHEMBL18912630 0.76 INSR (0.68) PDGFRBPDGFRAEGFRINSRIGF1R
SCHEMBL15244473 0.75 INSR (0.68) PDGFRBPDGFRAEGFRINSRIGF1R
SCHEMBL26087590 0.75 ALK (0.73) PDGFRBPDGFRAEGFRINSRIGF1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010138578-A1 PYRIMIDINE INHIBITORS OF KINASE ACTIVITY ABBOTT LABORATORIES (US) 2010-12-02 — — WO claimed
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