SCHEMBL14560439

SCHEMBL14560439

Cn1c(C=O)c(CCN2CCOCC2)c2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 4/20 0.50
▸ CNR2 P34972 4/20 0.50
▸ ALDH1A1 P00352 5/20 0.46
▸ KDM4E B2RXH2 4/20 0.46
▸ HSD17B10 Q99714 4/20 0.46
▸ HPGD P15428 3/20 0.45
▸ L3MBTL1 Q9Y468 3/20 0.44
▸ RAD52 P43351 1/20 0.44
▸ GAA P10253 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ TDP1 Q9NUW8 2/20 0.44
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ HTR7 P34969 2/20 0.43
▸ RXFP1 Q9HBX9 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ USP2 O75604 1/20 0.42
▸ ALOX15 P16050 1/20 0.42
▸ ATM Q13315 1/20 0.41
▸ ERN1 O75460 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
SCHEMBL14560451 0.74 HTR6 (0.47) ALDH1A1KDM4EL3MBTL1TDP1HTR7
SCHEMBL14560453 0.74 ALDH1A1 (0.48) ALDH1A1KDM4EHSD17B10HPGDL3MBTL1
SCHEMBL14560448 0.73 EGFR (0.50) CNR2ALDH1A1KDM4EHSD17B10HPGD
SCHEMBL14560443 0.73 EGFR (0.64) ALDH1A1KDM4EHSD17B10HPGDL3MBTL1
SCHEMBL14560446 0.72 RAD52 (0.49) ALDH1A1KDM4EHSD17B10HPGDL3MBTL1
SCHEMBL14560414 0.72 HTR2A (0.49) CNR1CNR2ALDH1A1KDM4EHSD17B10
SCHEMBL14560449 0.70 EGFR (0.47) ALDH1A1KDM4EHSD17B10HPGDL3MBTL1
SCHEMBL9691138 0.70 CNR2 (0.57) CNR1CNR2MEN1KMT2A
SCHEMBL28538811 0.69 CNR2 (0.58) CNR1CNR2ALDH1A1HPGDSMN1; SMN2
SCHEMBL27816681 0.69 LMNA (0.62) ALDH1A1KDM4EHSD17B10L3MBTL1SMN1; SMN2

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
US-7189721-B2 Bicyclic protein kinase inhibitors SUGEN INC. (US) 2007-03-13 — — US disclosed
US-7189721-B2 Bicyclic protein kinase inhibitors SUGEN INC. (US) 2007-03-13 — — US disclosed
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