SCHEMBL7471018

SCHEMBL7471018

Fc1cc2c(NCc3ccc4c(c3)OCCO4)ncnc2cc1N1CCNCC1

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 17/20 0.56
CLK4 Q9HAZ1 2/20 0.55
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
ALDH1A1 P00352 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49

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
SCHEMBL7462527 0.94 PDE5A (0.64) PDE5ACLK4MEN1KMT2AALDH1A1
SCHEMBL7470372 0.85 PDE5A (0.52) PDE5ACLK4MEN1KMT2AALDH1A1
SCHEMBL7470018 0.85 USP10 (0.57) PDE5AMEN1KMT2AALDH1A1
SCHEMBL7468592 0.85 PDE5A (0.52) PDE5ACLK4MEN1KMT2AALDH1A1
SCHEMBL7469278 0.84 PDE5A (0.70) PDE5ACLK4MEN1KMT2AALDH1A1
SCHEMBL7469507 0.84 PDE5A (0.50) PDE5ACLK4MEN1KMT2AALDH1A1
SCHEMBL7473397 0.80 PDE5A (0.59) PDE5ACLK4MEN1KMT2AALDH1A1
SCHEMBL7473037 0.78 SRC (0.49) PDE5AMEN1KMT2AALDH1A1
SCHEMBL7461671 0.78 HTT (0.52) MEN1KMT2ASMN1; SMN2
SCHEMBL7471052 0.78 PDE5A (0.82) PDE5ACLK4MEN1KMT2AALDH1A1

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
EP-1229025-A1 NOVEL QUINAZOLINE DERIVATIVES Japan Energy Corporation (JP) 2002-08-07 EP disclosed