SCHEMBL6141622

SCHEMBL6141622

CC(CO)CCc1ncnc2nc(N)[nH]c12

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PI4KA P42356 4/20 0.35
▸ PI4K2B Q8TCG2 4/20 0.35
▸ PI4K2A Q9BTU6 4/20 0.35
▸ PI4KB Q9UBF8 4/20 0.35
▸ KDM4E B2RXH2 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ THRB P10828 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ PKM P14618 1/20 0.33
▸ NUDT1 P36639 2/20 0.33
▸ ADORA2A P29274 1/20 0.32
▸ ADORA1 P30542 1/20 0.32
▸ PNP P00491 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ CXCR2 P25025 1/20 0.30

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
SCHEMBL4455866 0.86 PI4KA (0.38) PI4KAPI4K2BPI4K2API4KBKDM4E
SCHEMBL14778510 0.78 CYP1A2 (0.40) PI4KAPI4K2BPI4K2API4KBKDM4E
SCHEMBL6577280 0.70 CYP1A2 (0.36) PI4KAPI4K2BPI4K2API4KBKDM4E
SCHEMBL6141627 0.70 CDK2 (0.50) —
SCHEMBL3802729 0.70 TSHR (0.40) PI4KAPI4K2BPI4K2API4KBKDM4E
SCHEMBL5667619 0.69 ADORA2A (0.43) PI4KAPI4K2BPI4K2API4KBKDM4E
SCHEMBL9850315 0.68 NUDT1 (0.40) PI4KAPI4K2BPI4K2API4KBKDM4E
SCHEMBL14778508 0.67 CYP1A2 (0.39) KDM4EMEN1ALDH1A1KMT2ATSHR
SCHEMBL108321 0.66 LTB4R (0.55) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL320848 0.66 NUDT1 (0.43) PI4KAPI4K2BPI4K2API4KBKDM4E

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-0884293-B1 Fertiliser compositions containing natural or synthetic aminopurine derivatives or seaweed extracts containing these products together with a calcium source SECMA BIOTECHNOLOGIES MARINES (FR) 2005-01-05 — — EP claimed
EP-0884293-A1 Fertiliser compositions containing natural or synthetic aminopurine derivatives or seaweed extracts containing these products together with a calcium source SOCIETE D'ENGRAIS COMPOSES MINERAUX ET AMENDEMENTS (S.E.C.M.A.) (FR) 1998-12-16 — — EP claimed
EP-0884293-B1 Fertiliser compositions containing natural or synthetic aminopurine derivatives or seaweed extracts containing these products together with a calcium source SECMA BIOTECHNOLOGIES MARINES (FR) 2005-01-05 — — EP disclosed
EP-0884293-A1 Fertiliser compositions containing natural or synthetic aminopurine derivatives or seaweed extracts containing these products together with a calcium source SOCIETE D'ENGRAIS COMPOSES MINERAUX ET AMENDEMENTS (S.E.C.M.A.) (FR) 1998-12-16 — — EP disclosed
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