SCHEMBL7758289

SCHEMBL7758289

CCC(c1cccc(N(C(C)C)C(C)C)c1)c1cc(COC(=O)c2ccccc2)ccc1O

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.41
RAB9A P51151 6/20 0.41
NPC1 O15118 4/20 0.41
SLC6A2 P23975 1/20 0.40
SLC6A3 Q01959 1/20 0.40
KMT2A Q03164 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
ALDH1A1 P00352 5/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
KDM4E B2RXH2 2/20 0.40
HPGD P15428 1/20 0.40
LMNA P02545 2/20 0.38
POLB P06746 1/20 0.38
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
HSP90AA1 P07900 1/20 0.36
MAPK1 P28482 1/20 0.36

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
SCHEMBL11295974 0.89 ALDH1A1 (0.38) MAPTKMT2ATDP1ALDH1A1SMN1; SMN2
SCHEMBL15559016 0.85 THRA (0.34) MAPTKMT2ATDP1SMN1; SMN2LMNA
SCHEMBL15541447 0.83 CHRM3 (0.35) MAPTKMT2ATDP1SMN1; SMN2HPGD
SCHEMBL7758295 0.83 BCHE (0.38) MAPTKMT2ATDP1SMN1; SMN2LMNA
SCHEMBL7756317 0.81 BCHE (0.36) MAPTNPC1KMT2ATDP1ALDH1A1
SCHEMBL7752344 0.81 BCHE (0.36) MAPTKMT2ALMNA
SCHEMBL7752284 0.81 CHRM3 (0.38) MAPTKMT2ATDP1ALDH1A1SMN1; SMN2
SCHEMBL2167352 0.81 CHRM3 (0.38) MAPTKMT2ATDP1ALDH1A1SMN1; SMN2
SCHEMBL722593 0.81 CHRM3 (0.38) MAPTKMT2ATDP1ALDH1A1SMN1; SMN2
SCHEMBL7755082 0.80 BCHE (0.35) MAPTKMT2ATDP1SMN1; SMN2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1077912-A1 NOVEL DERIVATIVES OF 3,3-DIPHENYLPROPYLAMINES SCHWARZ PHARMA AG (DE) 2001-02-28 EP disclosed
WO-1999058478-A1 NOVEL DERIVATIVES OF 3,3-DIPHENYLPROPYLAMINES SCHWARZ PHARMA AG (DE) 1999-11-18 WO disclosed