SCHEMBL10686647

SCHEMBL10686647

CCOc1cc(OC)ccc1-c1nc2cnc(OC)nc2[nH]1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 1/20 0.42
CTSG P08311 1/20 0.42
KLK7 P49862 1/20 0.42
KLK14 Q9P0G3 1/20 0.42
KLK5 Q9Y337 1/20 0.42
MEN1 O00255 2/20 0.40
MAPT P10636 2/20 0.40
ALOX15 P16050 2/20 0.40
ALOX12 P18054 2/20 0.40
KMT2A Q03164 2/20 0.40
LMNA P02545 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
AMY1A P0DUB6 3/20 0.38
GUSB P08236 1/20 0.38
ALDH1A1 P00352 3/20 0.38
USP2 O75604 2/20 0.38
TP53 P04637 1/20 0.38
MAPK1 P28482 1/20 0.38
HSD17B10 Q99714 1/20 0.38

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
SCHEMBL10691944 0.91 GUSB (0.38) PDE2ACTSGKLK7KLK14KLK5
SCHEMBL10690574 0.90 PDE2A (0.51) PDE2ACTSGKLK7KLK14KLK5
SCHEMBL10610920 0.88 GUSB (0.36) PDE2ACTSGKLK7KLK14KLK5
SCHEMBL10692316 0.88 PDGFRB (0.43) MEN1MAPTALOX15ALOX12KMT2A
SCHEMBL10688930 0.87 MEN1 (0.39) MEN1MAPTALOX15ALOX12KMT2A
SCHEMBL11262076 0.84 EGFR (0.43) PDE2ACTSGKLK7KLK14KLK5
SCHEMBL10689009 0.82 PDE5A (0.39) MEN1KMT2ASMN1; SMN2HSD17B10KDM4E
SCHEMBL10686656 0.81 PDE2A (0.53) PDE2ACTSGKLK7KLK14KLK5
SCHEMBL10610355 0.81 PDE2A (0.40) PDE2ACYP1A2CYP3A4KDM4EHDAC3
SCHEMBL10613330 0.80 PDE5A (0.37) PDE2AMEN1MAPTALOX15KMT2A

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