SCHEMBL6766463

SCHEMBL6766463

O=Cc1cc2c([nH]1)CCCCN2CCCN1CCCCC1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TERT O14746 2/20 0.34
LMNA P02545 1/20 0.34
HRH3 Q9Y5N1 8/20 0.33
DRD2 P14416 2/20 0.33
DRD3 P35462 2/20 0.33
DRD4 P21917 1/20 0.33
NOS3 P29474 1/20 0.32
NOS1 P29475 1/20 0.32

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
SCHEMBL6320164 0.77 PARP1 (0.40) TERTDRD2DRD4
SCHEMBL5842762 0.67 TERT (0.52) TERTHRH3DRD2
SCHEMBL6319381 0.67 KDR (0.40)
SCHEMBL2559154 0.64 KDR (0.47) LMNA
SCHEMBL31159422 0.62 HRH3 (0.59) HRH3
SCHEMBL5414923 0.61 SRC (0.44)
SCHEMBL7265729 0.61 CYP1A2 (0.55)
SCHEMBL23828672 0.60 HRH3 (0.81) HRH3
SCHEMBL433324 0.60 HRH3 (0.81) HRH3
SCHEMBL13962337 0.60 HRH3 (0.81) HRH3

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-6677368-B2 4-aryl substituted indolinones SUGEN, INC. 2004-01-13 US disclosed