SCHEMBL10690472

SCHEMBL10690472

COc1ncc2[nH]c(-c3cc(OC)c(OC)cc3OC)nc2n1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 1/20 0.43
PDE5A O76074 5/20 0.41
AURKA O14965 1/20 0.41
AMY1A P0DUB6 7/20 0.40
PDE3B Q13370 2/20 0.39
PDE3A Q14432 2/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
CYP1A2 P05177 1/20 0.39
HPGD P15428 1/20 0.39
KMT2A Q03164 1/20 0.39
HSD17B10 Q99714 1/20 0.39
QPCT Q16769 1/20 0.35
QPCTL Q9NXS2 1/20 0.35
SLC2A1 P11166 1/20 0.34

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
Water SCHEMBL10868986 0.85 PDE2A (0.47) PDE2APDE5AAURKAAMY1APDE3B
Water SCHEMBL10869421 0.85 PDE2A (0.47) PDE2APDE5AAURKAAMY1APDE3B
SCHEMBL10691918 0.84 PKM (0.38) PDE2APDE5AAURKAAMY1APDE3B
SCHEMBL10690580 0.84 PDE2A (0.64) PDE2APDE5AAURKAAMY1APDE3B
SCHEMBL10689043 0.83 PDE2A (0.47) PDE2APDE5AAURKAPDE3BPDE3A
SCHEMBL10690518 0.83 AMY1A (0.47) PDE2APDE5AAURKAAMY1APDE3B
SCHEMBL10691379 0.81 PDE2A (0.46) PDE2APDE5AAURKAAMY1APDE3B
SCHEMBL10688273 0.80 PDE2A (0.35) PDE2APDE5AAURKAAMY1APDE3B
SCHEMBL10691950 0.77 PDE2A (0.45) PDE2APDE5AAURKAAMY1AKDM4E
SCHEMBL10686159 0.77 AURKA (0.35) PDE2APDE5AAURKAAMY1APDE3B

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
US-4722929-A Novel 2-phenyl-imidazoles and pharmaceutical compositions containing same DR. KARL THOMAE GMBH (DE) 1988-02-02 US disclosed
EP-0149200-A1 Novel 2-pnenyl-imidazoles, their preparation and drugs containing them Dr. Karl Thomae GmbH (DE) 1985-07-24 EP disclosed