SCHEMBL5889012

SCHEMBL5889012

C=CCc1cc(O)[c]c2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 4/20 0.40
GABRB2 P47870 4/20 0.40
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
POLB P06746 3/20 0.35
AKR1B1 P15121 2/20 0.35
AURKA O14965 1/20 0.35
DAPK3 O43293 1/20 0.35
MAP4K4 O95819 1/20 0.35
RET P07949 1/20 0.35
IGF1R P08069 1/20 0.35
MET P08581 1/20 0.35
PIM1 P11309 1/20 0.35
LTK P29376 1/20 0.35
KDR P35968 1/20 0.35
MAPK8 P45983 1/20 0.35
MAPK9 P45984 1/20 0.35
CDK8 P49336 1/20 0.35
CLK2 P49760 1/20 0.35
CDK9 P50750 1/20 0.35

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
SCHEMBL5889051 0.80 GABRA1 (0.47) GABRA1GABRB2MEN1KMT2APOLB
SCHEMBL5143350 0.77 GABRA1 (0.38) GABRA1GABRB2LMNAKDM4EALDH1A1
SCHEMBL9816460 0.72 NQO2 (0.50) GABRA1GABRB2MEN1KMT2APOLB
SCHEMBL9229519 0.72 MEN1 (0.51) GABRA1GABRB2MEN1KMT2APOLB
SCHEMBL2946940 0.70 GABRA1 (0.35) GABRA1GABRB2MEN1KMT2AAURKA
SCHEMBL1416395 0.70 TRPM4 (0.41) MEN1KMT2APOLBMAPTNPC1
SCHEMBL4410642 0.70 GABRA1 (0.40) GABRA1GABRB2MEN1KMT2APOLB
SCHEMBL5888951 0.70 TRPM4 (0.36) GABRA1GABRB2MEN1KMT2APOLB
SCHEMBL1396390 0.69 GABRA1 (0.31) GABRA1GABRB2MEN1KMT2AKDM4E
SCHEMBL472912 0.68 MEN1 (0.42) GABRA1GABRB2MEN1KMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7041388-B1 Substituted poly(arylene vinylenes), process for their preparation and their use in electroluminescent devices SEMICONDUCTORS GMBH (DE) 2006-05-09 US claimed