SCHEMBL22845183

SCHEMBL22845183

CCCC(CC)c1csc(CC)c1

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.38
TP53 P04637 1/20 0.30
RAB9A P51151 1/20 0.30
CA2 P00918 1/20 0.30
ALDH1A1 P00352 2/20 0.30
HPGD P15428 1/20 0.30
LMNA P02545 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
SCHEMBL23317392 0.88 NR1I2 (0.41) DAOCA2ALDH1A1HPGD
SCHEMBL23079345 0.84 CA2 (0.38) DAOCA2ALDH1A1HPGD
SCHEMBL24272221 0.79 CA2 (0.31) DAOCA2
SCHEMBL10141583 0.74 DAO (0.44) DAOTP53RAB9AALDH1A1HPGD
SCHEMBL22432014 0.69 CA2 (0.39) CA2
SCHEMBL29256493 0.68 DAO (0.43) DAOTP53RAB9ACA2ALDH1A1
SCHEMBL17428955 0.66 LMNA (0.45) DAOTP53RAB9AALDH1A1HPGD
SCHEMBL1700982 0.66 DAO (0.41) DAOTP53RAB9AALDH1A1LMNA
SCHEMBL13848615 0.65 CHRNB2 (0.36)
SCHEMBL23057961 0.65 CA2 (0.38) CA2

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
WO-2020264176-A1 UREA DERIVATIVES AS CB1 ALLOSTERIC MODULATORS RTI INTERNATIONAL (US) 2020-12-30 WO disclosed