SCHEMBL10691876

SCHEMBL10691876

COc1ccc(-c2nc3nc[nH]c(=O)c3[nH]2)c(OC)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 1/20 0.55
KDM4E B2RXH2 2/20 0.54
CYP1A2 P05177 1/20 0.54
CYP3A4 P08684 1/20 0.54
FGFR1 P11362 3/20 0.46
FGFR2 P21802 3/20 0.46
PDE5A O76074 1/20 0.46
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HSD17B10 Q99714 1/20 0.46
SRC P12931 1/20 0.44
ENPP1 P22413 1/20 0.43
CDC7 O00311 2/20 0.43
BRAF P15056 1/20 0.42
MAP3K5 Q99683 1/20 0.42
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42
XDH P47989 1/20 0.42
CTSG P08311 1/20 0.41
KLK7 P49862 1/20 0.41

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
SCHEMBL10691270 0.85 FGFR1 (0.44) PDE2AKDM4ECYP1A2CYP3A4FGFR1
SCHEMBL10688935 0.84 FGFR1 (0.43) PDE2AKDM4ECYP1A2CYP3A4FGFR1
SCHEMBL10686264 0.84 ENPP1 (0.45) PDE2AFGFR1FGFR2PDE5AHTT
SCHEMBL10688379 0.83 FGFR1 (0.45) PDE2AKDM4ECYP1A2CYP3A4FGFR1
SCHEMBL10692611 0.83 ENPP1 (0.46) PDE2AKDM4ECYP1A2CYP3A4FGFR1
SCHEMBL10688023 0.83 FGFR1 (0.42) PDE2AKDM4ECYP1A2CYP3A4FGFR1
SCHEMBL10693992 0.81 TNNI3K (0.41) PDE2AKDM4ECYP1A2CYP3A4FGFR1
SCHEMBL10685682 0.81 MAPT (0.45) PDE2AKDM4ECYP1A2CYP3A4FGFR1
SCHEMBL10685711 0.77 PDE2A (0.56) PDE2AKDM4ECYP1A2CYP3A4HTT
SCHEMBL13946121 0.74 ALDH1A1 (0.47) PDE2AKDM4ECYP1A2CYP3A4HTT

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 3 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
US-4544400-A HERBICIDES ZOECON CORPORATION (US) 1985-10-01 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