SCHEMBL7206430

SCHEMBL7206430

COc1cc2ncnc(C3C(=O)Nc4ccc(S(=O)(=O)NCCN5CCOCC5)cc43)c2cc1OC

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.46
ALDH1A1 P00352 3/20 0.46
MAPK1 P28482 2/20 0.46
CHEK1 O14757 1/20 0.46
KDM4E B2RXH2 1/20 0.46
KIT P10721 6/20 0.45
PDE5A O76074 1/20 0.43
POLB P06746 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
EGFR P00533 1/20 0.42
ILK Q13418 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
Hydrochloric Acid SCHEMBL7205053 0.99 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1MAPK1CHEK1KDM4E
SCHEMBL7210146 0.95 KIT (0.46) SMN1; SMN2ALDH1A1MAPK1CHEK1KDM4E
Hydrochloric Acid SCHEMBL7209863 0.94 KIT (0.46) SMN1; SMN2ALDH1A1MAPK1CHEK1KDM4E
SCHEMBL7205618 0.90 KIT (0.44) SMN1; SMN2ALDH1A1MAPK1CHEK1KIT
Hydrochloric Acid SCHEMBL7209982 0.90 KIT (0.43) SMN1; SMN2ALDH1A1MAPK1CHEK1KIT
Hydrochloric Acid SCHEMBL7212126 0.88 KIT (0.52) CHEK1KITEGFR
SCHEMBL7211365 0.86 CHEK1 (0.52) CHEK1KITEGFR
SCHEMBL7210071 0.86 CHEK1 (0.52) CHEK1KITEGFR
Hydrochloric Acid SCHEMBL7205688 0.85 CHEK1 (0.52) CHEK1KITEGFR
Hydrochloric Acid SCHEMBL8525709 0.83 CHEK1 (0.50) CHEK1KITEGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0912557-B1 OXINDOLE DERIVATIVES ASTRAZENECA AB (SE) 2003-07-09 EP disclosed
US-6265411-B1 ANGIOGENESIS INHIBITOR ZENECA LIMITED (GB) 2001-07-24 US disclosed
EP-0912557-A1 OXINDOLE DERIVATIVES ZENECA LIMITED (GB) 1999-05-06 EP disclosed
WO-1997042187-A1 OXINDOLE DERIVATIVES ZENECA LIMITED (GB) 1997-11-13 WO disclosed