SCHEMBL7363585

SCHEMBL7363585

COc1ccccc1OCNC(=O)c1cccc2nc[nH]c12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 2/20 0.47
POLB P06746 3/20 0.43
TDP1 Q9NUW8 1/20 0.43
HPGD P15428 3/20 0.42
TP53 P04637 1/20 0.42
GLA P06280 1/20 0.42
HSD17B10 Q99714 2/20 0.41
CTSD P07339 1/20 0.41
MTNR1A P48039 1/20 0.40
MTNR1B P49286 1/20 0.40
LMNA P02545 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
CYP1A2 P05177 1/20 0.40
KMT2A Q03164 1/20 0.40
STAT3 P40763 1/20 0.40
KDM4E B2RXH2 1/20 0.40
ATM Q13315 1/20 0.40
NPC1 O15118 1/20 0.40

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
SCHEMBL4440945 0.85 HPGD (0.63) POLBHPGDHSD17B10MEN1ALDH1A1
SCHEMBL7369653 0.85 BRD4 (0.41) BRD4TDP1HPGDLMNASMN1; SMN2
SCHEMBL536590 0.74 KDM4E (0.46) BRD4POLBTDP1HPGDHSD17B10
SCHEMBL1477696 0.74 P2RX7 (0.45) BRD4POLBTDP1CTSDLMNA
Potassium SCHEMBL29729324 0.73 KDM4E (0.45) BRD4POLBTDP1HPGDHSD17B10
SCHEMBL3082549 0.72 ABL1 (0.54) BRD4POLBHPGDTP53HSD17B10
Acetic Acid SCHEMBL27464432 0.71 KDM4E (0.43) BRD4POLBTDP1HPGDHSD17B10
SCHEMBL5823499 0.71 MAPT (0.44) BRD4POLBLMNASMN1; SMN2MEN1
SCHEMBL31538912 0.70 ABL1 (0.53) BRD4POLBHPGDTP53HSD17B10
SCHEMBL1382500 0.70 TSHR (0.56) BRD4TDP1HPGDTP53GLA

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-0934307-A1 SUBSTITUTED AZABICYLIC COMPOUNDS AND THEIR USE AS INHIBITORS OF THE PRODUCTION OF TNF AND CYCLIC AMP PHOSPHODIESTERASE RHONE-POULENC RORER LIMITED (GB) 1999-08-11 EP claimed
WO-1997048697-A1 SUBSTITUTED AZABICYLIC COMPOUNDS AND THEIR USE AS INHIBITORS OF THE PRODUCTION OF TNF AND CYCLIC AMP PHOSPHODIESTERASE RHONE-POULENC RORER LIMITED (GB) 1997-12-24 WO claimed