SCHEMBL8069285

SCHEMBL8069285

CCOCn1c(Oc2cc(C)cc(C)c2)c(C(C)C)c(=O)[nH]c1=O

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.34
PDE3B Q13370 1/20 0.31
PDE3A Q14432 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL12829055 0.88 MAOB (0.36) ALDH1A1PDE3BPDE3AMEN1KMT2A
SCHEMBL8071758 0.87 MEN1 (0.35) ALDH1A1PDE3BPDE3AMEN1KMT2A
SCHEMBL8067216 0.87 PNP (0.36) ALDH1A1
SCHEMBL8071853 0.85 ALDH1A1 (0.54) ALDH1A1MEN1KMT2A
SCHEMBL8058413 0.84 ALDH1A1 (0.43) ALDH1A1MEN1KMT2AMAPT
SCHEMBL8067201 0.84 MEN1 (0.35) ALDH1A1MEN1KMT2ATDP1MAPT
SCHEMBL7037489 0.83 SMN1; SMN2 (0.36) ALDH1A1PDE3BPDE3AMEN1KMT2A
SCHEMBL6087128 0.83 TPH1 (0.34) ALDH1A1PDE3BPDE3AMEN1KMT2A
SCHEMBL6087134 0.81 MEN1 (0.32) PDE3BPDE3AMEN1KMT2ATDP1
SCHEMBL1484944 0.81 PDE3B (0.31) PDE3BPDE3A

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-6136815-A VIRICIDES FOR TREATMENT OF AIDS KOREA RESEARCH INST. OF CHEM. TECH. (KR) 2000-10-24 US disclosed