SCHEMBL6203722

SCHEMBL6203722

O=CCC(=O)N1CCCC1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.52
ALDH1A1 P00352 4/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.43
GAA P10253 1/20 0.43
TDP1 Q9NUW8 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
BPTF Q12830 1/20 0.39
NPC1 O15118 2/20 0.38
TSHR P16473 1/20 0.38
HPGD P15428 1/20 0.37
HTT P42858 1/20 0.37
KDM4E B2RXH2 1/20 0.37
LMNA P02545 1/20 0.37

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
SCHEMBL3082371 1.00 ATM (0.52) ATMALDH1A1SMN1; SMN2L3MBTL1GAA
SCHEMBL27396631 0.98 ATM (0.50) ATMALDH1A1SMN1; SMN2L3MBTL1GAA
SCHEMBL4184360 0.81 ALDH1A1 (0.38) ATMALDH1A1SMN1; SMN2GAATDP1
SCHEMBL8185942 0.79 CYP1A2 (0.48) ALDH1A1SMN1; SMN2GAATDP1MEN1
SCHEMBL30455653 0.79 CA2 (0.45) GAAKMT2A
SCHEMBL3582413 0.79 L3MBTL1 (0.55) ALDH1A1SMN1; SMN2L3MBTL1GAAMEN1
SCHEMBL3949996 0.79 CYP1A2 (0.48) SMN1; SMN2L3MBTL1TDP1KMT2AHTT
SCHEMBL5517609 0.78 ATM (0.50) ATMALDH1A1SMN1; SMN2L3MBTL1GAA
SCHEMBL2184936 0.78 ATM (0.50) ATMALDH1A1SMN1; SMN2L3MBTL1GAA
SCHEMBL27978837 0.78 ATM (0.50) ATMALDH1A1SMN1; SMN2L3MBTL1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1506175-A1 N-SUBSTITUTED TRICYCLIC 3-AMINOPYRAZOLES AS PDGF RECEPTOR INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2005-02-16 EP claimed
WO-2003097609-A1 N-SUBSTITUTED TRICYCLIC 3-AMINOPYRAZOLES AS PDFG RECEPTOR INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2003-11-27 WO claimed