SCHEMBL8563665

SCHEMBL8563665

COCCOc1c[c]ncc1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.35
DYRK1A Q13627 1/20 0.35
CCNK O75909 1/20 0.35
CDK12 Q9NYV4 1/20 0.35
TSHR P16473 1/20 0.34
BRAF P15056 1/20 0.33
KDM4E B2RXH2 1/20 0.33
RECQL P46063 1/20 0.33
CHEK2 O96017 1/20 0.32
CHRNB2 P17787 3/20 0.32
CHRNA4 P43681 3/20 0.32
GRM4 Q14833 1/20 0.32
NOS2 P35228 1/20 0.31
APP P05067 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL12468864 0.81 CYP2D6 (0.49) TSHRKDM4EMAPT
SCHEMBL9480424 0.80 NR5A1 (0.44) TSHR
SCHEMBL3048497 0.79 APP (0.40) APPMAPT
SCHEMBL2066513 0.79
SCHEMBL3052807 0.77 APP (0.45) APPMAPT
SCHEMBL3048803 0.77 APP (0.45) APPMAPT
SCHEMBL294190 0.76
SCHEMBL10090149 0.74 CYP2D6 (0.52) MAOADYRK1ATSHRBRAFKDM4E
SCHEMBL9480278 0.74 APP (0.53) APPMAPT
SCHEMBL1201374 0.71 NFE2L2 (0.50)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0586393-B1 SUBSTITUTED-2-PHENYL-3-METHOXYPROPENOATES AS FUNGICIDES ZENECA LTD (GB) 1998-06-17 EP claimed
US-5439910-A For applying to plants, seeds or soils ZENECA LIMITED (GB) 1995-08-08 US claimed
CN-112654608-B Fused ring compound having urea structure 桑福德伯纳姆普利斯医学发现研究所 2024-05-07 CN disclosed
EP-3818053-A1 FUSED RING COMPOUND HAVING UREA STRUCTURE Sanford Burnham Prebys Medical Discovery Institute (US) 2021-05-12 EP disclosed
CN-112654608-A Condensed ring compounds having urea structure 桑福德伯纳姆普利斯医学发现研究所 2021-04-13 CN disclosed