SCHEMBL9507485

SCHEMBL9507485

COc1cc[c]c(-c2ccc(N(C)C)cc2C)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SNCA P37840 1/20 0.37
APP P05067 4/20 0.36
CALM1 P0DP23 2/20 0.36
MAOB P27338 2/20 0.35
MAOA P21397 1/20 0.35
SLC2A1 P11166 1/20 0.35
TLR9 Q9NR96 1/20 0.34
TLR7 Q9NYK1 1/20 0.34
MAPT P10636 3/20 0.33
LMNA P02545 2/20 0.33
MEN1 O00255 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
TSHR P16473 1/20 0.33
CYP2C19 P33261 1/20 0.33
KMT2A Q03164 1/20 0.33
GLA P06280 2/20 0.32
GAA P10253 2/20 0.32
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32

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
SCHEMBL6780746 0.88 SNCA (0.37) SNCAAPPCALM1MAOBMAOA
SCHEMBL9509841 0.87 TLR9 (0.42) SNCAAPPCALM1MAOBMAOA
SCHEMBL8067213 0.85 MAOB (0.40) SNCAAPPCALM1MAOBMAOA
SCHEMBL9509488 0.84 MAPT (0.39) APPMAPTTSHRKDM4EALDH1A1
SCHEMBL9509806 0.84 SNCA (0.36) SNCAAPPCALM1MAOBMAOA
SCHEMBL9508228 0.84 SNCA (0.36) SNCAAPPCALM1MAOBMAOA
SCHEMBL8529081 0.81 ACHE (0.40) SNCAAPPMAOBMAPTMEN1
SCHEMBL8063028 0.78 APP (0.49) SNCAAPPCALM1SLC2A1TLR9
SCHEMBL8125196 0.76 CYP1A2 (0.40) MAPTLMNAMEN1CYP1A2CYP3A4
SCHEMBL5887447 0.75 HSD17B2 (0.46) APP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4922018-A Photoconductive imaging members with unsymmetrical squaraine compositions XEROX CORPORATION (US) 1990-05-01 US claimed
US-4886722-A Photoconductive imaging members with unsymmetrical squaraine compositions XEROX CORPORATION (US) 1989-12-12 US claimed
EP-0396828-B1 UNSYMMETRICAL SQUARAINE COMPOSITIONS AND PHOTOCONDUCTIVE IMAGING MEMBERS USING SUCH COMPOSITIONS XEROX CORPORATION (US) 1993-08-11 EP disclosed
US-5230975-A Photoconductive imaging members with unsymmetrical alkylalkoxy squaraine compositions XEROX CORPORATION (US) 1993-07-27 US disclosed
US-5106713-A Photoconductive imaging members with unsymmetrical squaraine compositions XEROX CORPORATION (US) 1992-04-21 US disclosed
US-5077160-A PHOTOCONDUCTIVE IMAGING MEMBERS WITH FLUORINATED SQUARAINE COMPOSITIONS XEROX CORPORATION (US) 1991-12-31 US disclosed
US-5030537-A Photoconductive unsymmetrical squaraine compositions XEROX CORPORATION (US) 1991-07-09 US disclosed
EP-0396828-A1 Unsymmetrical squaraine compositions and photoconductive imaging members using such compositions XEROX CORPORATION (US) 1990-11-14 EP disclosed
US-4922018-A Photoconductive imaging members with unsymmetrical squaraine compositions XEROX CORPORATION (US) 1990-05-01 US disclosed
US-4886722-A Photoconductive imaging members with unsymmetrical squaraine compositions XEROX CORPORATION (US) 1989-12-12 US disclosed