SCHEMBL7008087

SCHEMBL7008087

COc1ccc(N2C(=O)Cc3ccccc32)cc1OC

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.58
LMNA P02545 1/20 0.55
GAA P10253 2/20 0.53
CASP3 P42574 1/20 0.53
CASP6 P55212 1/20 0.53
SENP8 Q96LD8 1/20 0.53
SENP7 Q9BQF6 1/20 0.53
SENP6 Q9GZR1 1/20 0.53
ALDH1A1 P00352 5/20 0.48
KMT2A Q03164 2/20 0.48
CASP1 P29466 1/20 0.48
CYP2C9 P11712 2/20 0.46
TNKS O95271 1/20 0.44
G6PD P11413 1/20 0.43
TLR9 Q9NR96 1/20 0.43
PDE4A P27815 2/20 0.43
PDE4B Q07343 2/20 0.43
PDE4C Q08493 2/20 0.43
PDE4D Q08499 2/20 0.43
NR1H3 Q13133 2/20 0.42

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
SCHEMBL10398766 0.88 ALDH1A1 (0.57) HPGDLMNAGAACASP3CASP6
SCHEMBL10398716 0.88 HPGD (0.54) HPGDLMNAGAACASP3CASP6
SCHEMBL6772611 0.81 HPGD (0.64) HPGDLMNAGAACASP3CASP6
SCHEMBL6329014 0.81 HPGD (0.68) HPGDGAACASP3CASP6SENP8
SCHEMBL8819491 0.79 PSEN1 (0.50) HPGD
SCHEMBL16456324 0.75 HPGD (0.74) HPGDLMNAGAACASP3CASP6
SCHEMBL12962502 0.75 LMNA (0.73) LMNAGAAALDH1A1KMT2ACYP2C9
SCHEMBL31422646 0.74 HPGD (1.00) HPGDGAACASP3CASP6SENP8
SCHEMBL143970 0.74 HPGD (1.00) HPGDGAACASP3CASP6SENP8
SCHEMBL22500073 0.74 HPGD (0.58) HPGDGAACASP3CASP6SENP8

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-1349852-A2 4-(HETERO)ARYL SUBSTITUTED INDOLINONES Sugen, Inc. (US) 2003-10-08 EP disclosed
WO-2002055517-A2 4-(HETERO)ARYL SUBSTITUTED INDOLINONES CUI JINGRONG (US) 2002-07-18 WO disclosed