SCHEMBL604293

SCHEMBL604293

CCc1c(N)cc(Cl)c(Cl)c1CC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.42
CD44 P16070 1/20 0.39
CYP3A4 P08684 4/20 0.35
TSHR P16473 3/20 0.35
NPC1 O15118 2/20 0.35
MEN1 O00255 1/20 0.35
USP2 O75604 1/20 0.35
EGFR P00533 1/20 0.35
LMNA P02545 1/20 0.35
ESR1 P03372 1/20 0.35
ERBB2 P04626 1/20 0.35
CYP1A2 P05177 1/20 0.35
LCK P06239 1/20 0.35
FYN P06241 1/20 0.35
PGR P06401 1/20 0.35
POLB P06746 1/20 0.35
HSP90AA1 P07900 1/20 0.35
HTR1A P08908 1/20 0.35
ADRA2A P08913 1/20 0.35
ADORA3 P0DMS8 1/20 0.35

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
SCHEMBL8960982 0.82 GAA (0.42) GAACD44CYP3A4TSHRNPC1
SCHEMBL14143885 0.78 HPGD (0.48) CYP3A4TSHRNPC1MEN1USP2
SCHEMBL9017622 0.75 POLB (0.35) GAACD44CYP3A4LMNACYP1A2
SCHEMBL3668733 0.73 GAA (0.42) GAACD44CYP3A4TSHRNPC1
SCHEMBL3031653 0.72 GAA (0.37) GAACD44CYP3A4TSHRNPC1
SCHEMBL31532254 0.72 GAA (0.37) GAACD44CYP3A4TSHRNPC1
SCHEMBL21052048 0.71 CYP3A4 (0.39) GAACD44CYP3A4HTR1ASLC6A2
SCHEMBL31676788 0.71 CYP3A4 (0.39) GAACD44CYP3A4HTR1ASLC6A2
Hydrochloric Acid SCHEMBL8075443 0.71 GAA (0.36) GAACD44CYP3A4TSHRNPC1
SCHEMBL6162367 0.70 CYP3A4 (0.37) GAACD44CYP3A4TSHRALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8748540-B2 Compositions comprising solvated aromatic amines and methods for the preparation thereof Crosslink Technology, Inc 2014-06-10 US claimed
WO-2010118527-A1 COMPOSITIONS COMPRISING SOLVATED AROMATIC AMINES AND METHODS FOR THE PREPARATION THEREOF CROSSLINK TECHNOLOGY INC. (CA) 2010-10-21 WO claimed
US-8748540-B2 Compositions comprising solvated aromatic amines and methods for the preparation thereof Crosslink Technology, Inc 2014-06-10 US disclosed
US-20120040094-A1 Compositions Comprising Solvated Aromatic Amines and Methods for the Preparation Thereof CROSSLINK TECHNOLOGY, INC. (CA) 2012-02-16 US disclosed
WO-2010118527-A1 COMPOSITIONS COMPRISING SOLVATED AROMATIC AMINES AND METHODS FOR THE PREPARATION THEREOF CROSSLINK TECHNOLOGY INC. (CA) 2010-10-21 WO disclosed