SCHEMBL23749500

SCHEMBL23749500

Nc1ccc(Oc2ccnc3cc(OCCCN4CCCC4)c4c(c23)OCCO4)c(F)c1

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
AXL P30530 1/20 0.59
RET P07949 5/20 0.57
KDR P35968 6/20 0.47
EGFR P00533 2/20 0.47
MET P08581 4/20 0.45
RAF1 P04049 2/20 0.44
BRAF P15056 2/20 0.44
EHMT2 Q96KQ7 1/20 0.43
EHMT1 Q9H9B1 1/20 0.43

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
SCHEMBL31441112 1.00 AXL (0.59) AXLRETKDREGFRMET
SCHEMBL23749319 0.99 AXL (0.58) AXLRETKDREGFRMET
SCHEMBL21265307 0.94 AXL (0.68) AXLRETKDREGFRMET
SCHEMBL23749340 0.93 AXL (0.60) AXLRETKDREGFRMET
SCHEMBL23749501 0.91 RET (0.56) AXLRETKDREGFRMET
SCHEMBL23749350 0.91 AXL (0.57) AXLRETKDREGFRMET
SCHEMBL23749499 0.91 AXL (0.55) AXLRETKDREGFRMET
SCHEMBL23749330 0.90 AXL (0.57) AXLRETKDREGFRMET
SCHEMBL23749577 0.90 AXL (0.57) AXLRETKDREGFRMET
SCHEMBL23749358 0.89 RET (0.57) AXLRETKDREGFRMET

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-3865487-A1 AROMATIC RING-LINKED DIOXANE-QUINAZOLINE OR -QUINOLINE COMPOUNDS, COMPOSITIONS AND USE THEREOF Beijing Scitech-MQ Pharmaceuticals Limited (CN) 2021-08-18 EP disclosed
EP-3865487-A1 AROMATIC RING-LINKED DIOXANE-QUINAZOLINE OR -QUINOLINE COMPOUNDS, COMPOSITIONS AND USE THEREOF Beijing Scitech-MQ Pharmaceuticals Limited (CN) 2021-08-18 EP disclosed