SCHEMBL6769672

SCHEMBL6769672

CNc1nc(OCc2cccnn2)nc2c1ncn2Cc1ccc(OC)c(OC2CCCC2)c1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
AXL P30530 2/20 0.49
MERTK Q12866 2/20 0.49
FLT3 P36888 1/20 0.49
YTHDC1 Q96MU7 2/20 0.47
PDE4A P27815 16/20 0.45
PDE4B Q07343 16/20 0.45
PDE4C Q08493 16/20 0.45
PDE4D Q08499 16/20 0.45
TYRO3 Q06418 1/20 0.41

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
SCHEMBL6780155 0.93 PDE4A (0.46) AXLMERTKFLT3YTHDC1PDE4A
SCHEMBL6773096 0.81 YTHDC1 (0.71) AXLMERTKFLT3YTHDC1PDE4A
SCHEMBL6768490 0.80 PDE4A (0.38) PDE4APDE4BPDE4CPDE4D
SCHEMBL6768489 0.72 PDE4A (0.55) YTHDC1PDE4APDE4BPDE4CPDE4D
SCHEMBL3582728 0.72 PDE4A (0.51) YTHDC1PDE4APDE4BPDE4CPDE4D
SCHEMBL3121249 0.66 POLB (0.48) PDE4APDE4BPDE4CPDE4D
SCHEMBL6769137 0.66 PDE4A (0.46) PDE4APDE4BPDE4CPDE4D
SCHEMBL27387501 0.65 YTHDC1 (1.00) YTHDC1
SCHEMBL6865485 0.65 YTHDC1 (0.47) AXLMERTKFLT3YTHDC1PDE4A
SCHEMBL6675074 0.65 PDE4B (0.57) PDE4APDE4BPDE4CPDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1043324-B1 PURINE DERIVATIVES AND MEDICINE CONTAINING THE SAME AS THE ACTIVE INGREDIENT MITSUBISHI CHEM CORP (JP) 2004-06-16 EP claimed
US-6734187-B1 ANTIASTHMATIC AGENTS MITSUBISHI CHEMICAL CORPORATION (JP) 2004-05-11 US claimed
EP-1043324-A1 PURINE DERIVATIVES AND MEDICINE CONTAINING THE SAME AS THE ACTIVE INGREDIENT MITSUBISHI CHEMICAL CORPORATION (JP) 2000-10-11 EP claimed
EP-1043324-B1 PURINE DERIVATIVES AND MEDICINE CONTAINING THE SAME AS THE ACTIVE INGREDIENT MITSUBISHI CHEM CORP (JP) 2004-06-16 EP disclosed
US-6734187-B1 ANTIASTHMATIC AGENTS MITSUBISHI CHEMICAL CORPORATION (JP) 2004-05-11 US disclosed
EP-1043324-A1 PURINE DERIVATIVES AND MEDICINE CONTAINING THE SAME AS THE ACTIVE INGREDIENT MITSUBISHI CHEMICAL CORPORATION (JP) 2000-10-11 EP disclosed