SCHEMBL2772216

SCHEMBL2772216

Cc1cccc(N(c2ccc(C3=CCC(Cl)(c4ccccc4)C=C3)cc2)c2cccc(C)c2)c1

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.33
MEN1 O00255 1/20 0.33
CYP1A2 P05177 1/20 0.33
POLB P06746 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
KMT2A Q03164 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
ICMT O60725 1/20 0.31
NPC1 O15118 1/20 0.30
JAK2 O60674 1/20 0.30
ALDH1A1 P00352 1/20 0.30
RAB9A P51151 1/20 0.30
PAX8 Q06710 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
SCHEMBL2769438 0.87 MEN1 (0.34) MEN1KMT2ANPSR1
SCHEMBL8862832 0.83 ICMT (0.30) ICMT
SCHEMBL21480360 0.81
SCHEMBL31377502 0.80 TP53 (0.30) POLB
SCHEMBL15514367 0.80 TP53 (0.30) POLB
SCHEMBL31124412 0.80 TP53 (0.30) POLB
SCHEMBL31748685 0.80 TP53 (0.30) POLB
SCHEMBL16469637 0.80 TP53 (0.30) POLB
SCHEMBL1144654 0.80 TP53 (0.30) POLB
SCHEMBL2773423 0.76 OPRM1 (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1965260-B1 Imaging member comprising asymmetric arylamine compounds and processes for making these compounds XEROX CORP (US) 2010-04-21 EP disclosed
EP-1965260-A1 Asymmetric arylamine compounds and processes for making the same Xerox Corporation (US) 2008-09-03 EP disclosed
US-20080206662-A1 Asymmetric arylamine compounds and processes for making the same XEROX CORPORATION (US) 2008-08-28 US disclosed