SCHEMBL10690462

SCHEMBL10690462

COc1ncc2nc(-c3cc(OC)c(OC)cc3OC)[nH]c2n1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
AMY1A P0DUB6 7/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
POLB P06746 1/20 0.39
CYP1A2 P05177 2/20 0.37
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
QPCT Q16769 1/20 0.35
QPCTL Q9NXS2 1/20 0.35
PDE3B Q13370 1/20 0.35
PDE3A Q14432 1/20 0.35
PDE5A O76074 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
SCHEMBL10691911 0.84 PKM (0.38) CYP1A2PDE3BPDE3APDE5A
SCHEMBL10690574 0.84 PDE2A (0.51) AMY1ACYP1A2KDM4EALDH1A1PDE3B
SCHEMBL10689035 0.83 ESR1 (0.42) AMY1APOLBPDE3BPDE3APDE5A
SCHEMBL10690513 0.83 AMY1A (0.47) AMY1ACYP1A2ALDH1A1PDE3BPDE3A
SCHEMBL10688260 0.80 NR1I2 (0.34) AMY1ASMN1; SMN2CYP1A2KDM4EALDH1A1
SCHEMBL10686151 0.78 EGFR (0.35) AMY1ASMN1; SMN2POLBCYP1A2KDM4E
SCHEMBL10691944 0.77 GUSB (0.38) AMY1ASMN1; SMN2KDM4EALDH1A1PDE5A
SCHEMBL10610355 0.77 PDE2A (0.40) CYP1A2KDM4EPDE3BPDE3APDE5A
SCHEMBL10690472 0.77 PDE2A (0.43) AMY1ACYP1A2KDM4EALDH1A1QPCT
SCHEMBL10685926 0.76 PDGFRB (0.48) POLBKDM4E

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