SCHEMBL7209528

SCHEMBL7209528

COc1cc2c(C3C(=O)Nc4cc(C(F)(F)F)ccc43)ncnc2cc1OCCCN1CCOCC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 1/20 0.58
EGFR P00533 10/20 0.54
SRC P12931 8/20 0.49
KDR P35968 5/20 0.49
KDM1A O60341 1/20 0.48
BRAF P15056 3/20 0.47
FLT4 P35916 2/20 0.47
KIT P10721 2/20 0.47
CIT O14578 1/20 0.47
GAK O14976 1/20 0.47
EPHB6 O15197 1/20 0.47
ABCC4 O15439 1/20 0.47
DAPK3 O43293 1/20 0.47
RIPK2 O43353 1/20 0.47
NR1I2 O75469 1/20 0.47
RPS6KA4 O75676 1/20 0.47
STK17B O94768 1/20 0.47
STK10 O94804 1/20 0.47
PRKD3 O94806 1/20 0.47
ABCB11 O95342 1/20 0.47

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
SCHEMBL4506578 0.90 CHEK1 (0.60) CHEK1EGFRSRCKDRKDM1A
Hydrochloric Acid SCHEMBL7205696 0.90 CHEK1 (0.59) CHEK1EGFRSRCKDRKDM1A
SCHEMBL5493950 0.90 EGFR (0.51) CHEK1EGFRSRCKDRKDM1A
SCHEMBL6587892 0.89 CHEK1 (0.60) CHEK1EGFRSRCKDRKDM1A
Hydrochloric Acid SCHEMBL4508490 0.88 CHEK1 (0.59) CHEK1EGFRSRCKDRKDM1A
SCHEMBL7205019 0.88 CHEK1 (0.58) CHEK1EGFRSRCKDRKDM1A
SCHEMBL7211414 0.88 CHEK1 (0.58) CHEK1EGFRSRCKDRKDM1A
Hydrochloric Acid SCHEMBL7211395 0.87 CHEK1 (0.57) CHEK1EGFRSRCKDRKDM1A
SCHEMBL7205685 0.87 CHEK1 (0.75) CHEK1EGFRSRCKDRBRAF
SCHEMBL4519142 0.87 CHEK1 (0.77) CHEK1EGFRSRCKDRKDM1A

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

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