SCHEMBL7279499

SCHEMBL7279499

COC([C]=O)Cc1cccc2ccccc12

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CTNNB1 P35222 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.44
ATM Q13315 1/20 0.42
CYP1A2 P05177 2/20 0.42
CYP2C19 P33261 2/20 0.42
CYP2D6 P10635 1/20 0.42
TDP1 Q9NUW8 3/20 0.41
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MMP9 P14780 1/20 0.41
CYP2C9 P11712 1/20 0.41
ACP3 P15309 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TACR1 P25103 1/20 0.40
SIGMAR1 Q99720 1/20 0.40
SLC6A4 P31645 1/20 0.40

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
SCHEMBL9665237 0.82 CTNNB1 (0.48) CTNNB1L3MBTL1ATMTDP1ALDH1A1
SCHEMBL6447126 0.81 CTSS (0.41) CTNNB1L3MBTL1CYP1A2CYP2C19CYP2D6
SCHEMBL9665981 0.79 CTNNB1 (0.45) CTNNB1L3MBTL1ATMTDP1ALDH1A1
SCHEMBL10390179 0.79 CNR2 (0.41) CTNNB1L3MBTL1TDP1CYP2C9GAA
SCHEMBL6447891 0.78 TDP1 (0.48) CTNNB1L3MBTL1ATMCYP1A2CYP2C19
SCHEMBL10857564 0.78 CTNNB1 (0.49) CTNNB1CYP1A2CYP2C19CYP2D6TDP1
SCHEMBL15750674 0.78 CTNNB1 (0.49) CTNNB1L3MBTL1ATMCYP1A2CYP2C19
SCHEMBL6444721 0.78 CTNNB1 (0.44) CTNNB1L3MBTL1ATMTDP1ALDH1A1
SCHEMBL6443448 0.78 CTSS (0.46) CTNNB1L3MBTL1ATMTDP1ALDH1A1
SCHEMBL6743982 0.78 CTNNB1 (0.51) CTNNB1CYP1A2CYP2C19CYP2D6TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5047397-A Natriuretics, diuretics, vasodilators CALIFORNIA BIOTECHNOLOGY INC. (US) 1991-09-10 US disclosed
EP-0410989-A4 CYCLIC ANALOGS OF ATRIAL NATRIURETIC PEPTIDES 1991-06-05 EP disclosed
EP-0410989-A1 CYCLIC ANALOGS OF ATRIAL NATRIURETIC PEPTIDES CALIFORNIA BIOTECHNOLOGY, INC. (US) 1991-02-06 EP disclosed
US-4935492-A Cyclic analogs of atrial natriuretic peptides CALIFORNIA BIOTECHNOLOGY INC. (US) 1990-06-19 US disclosed
WO-1989009611-A1 CYCLIC ANALOGS OF ATRIAL NATRIURETIC PEPTIDES CALIFORNIA BIOTECHNOLOGY INC. (US) 1989-10-19 WO disclosed
EP-0323740-A2 Linear analogs of atrial natriuretic peptides CALIFORNIA BIOTECHNOLOGY, INC. (US) 1989-07-12 EP disclosed
WO-1989005654-A1 LINEAR ANALOGS OF ATRIAL NATRIURETIC PEPTIDES CALIFORNIA BIOTECHNOLOGY INC. (US) 1989-06-29 WO disclosed