SCHEMBL7980984

SCHEMBL7980984

COc1cc2[nH]c(=O)c3ccccc3c2cc1OC

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.62
ALDH1A1 P00352 4/20 0.62
HPGD P15428 2/20 0.62
SMN1; SMN2 Q16637 1/20 0.62
GRIN2D O15399 1/20 0.58
GRIN3B O60391 1/20 0.58
GRIN1 Q05586 1/20 0.58
GRIN2A Q12879 1/20 0.58
GRIN2B Q13224 1/20 0.58
GRIN2C Q14957 1/20 0.58
GRIN3A Q8TCU5 1/20 0.58
PARP1 P09874 5/20 0.57
BRD4 O60885 3/20 0.53
HSD17B10 Q99714 2/20 0.53
MEN1 O00255 1/20 0.53
TNKS O95271 1/20 0.53
LMNA P02545 1/20 0.53
CYP1A2 P05177 1/20 0.53
GPR3 P46089 1/20 0.53
BLM P54132 1/20 0.53

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
SCHEMBL7983954 0.85 ALDH1A1 (0.70) KDM4EALDH1A1HPGDSMN1; SMN2GRIN2D
SCHEMBL7983972 0.80 KDM4E (0.77) KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL31195781 0.77 KDM4E (0.61) KDM4EALDH1A1HPGDSMN1; SMN2GRIN2D
SCHEMBL7983948 0.77 KDM4E (0.61) KDM4EALDH1A1HPGDSMN1; SMN2GRIN2D
SCHEMBL2895978 0.77 KDM4E (1.00) KDM4EALDH1A1HPGDSMN1; SMN2GRIN2D
SCHEMBL1292034 0.75 GRIN2D (1.00) KDM4EALDH1A1HPGDSMN1; SMN2GRIN2D
SCHEMBL20597299 0.75 ABCG2 (0.67) KDM4EALDH1A1HPGDSMN1; SMN2PARP1
SCHEMBL14280975 0.74 CA1 (0.55) KDM4EALDH1A1HPGDSMN1; SMN2MEN1
SCHEMBL2553439 0.74 GRIN2D (0.51) KDM4EALDH1A1HPGDSMN1; SMN2GRIN2D
SCHEMBL7985105 0.74 GRIN2D (0.51) KDM4EALDH1A1HPGDSMN1; SMN2GRIN2D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6194439-B1 ANTICANCER AGENT PFIZER INC. 2001-02-27 US disclosed
EP-0586608-A1 TRICYCLIC POLYHYDROXYLIC TYROSINE KINASE INHIBITORS PFIZER INC. (US) 1994-03-16 EP disclosed
WO-1992021660-A1 TRICYCLIC POLYHYDROXYLIC TYROSINE KINASE INHIBITORS PFIZER, INC. (US) 1992-12-10 WO disclosed