SCHEMBL8178201

SCHEMBL8178201

Cc1ccc(N(c2ccccc2)c2ccc(O)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.56
CYP2C19 P33261 3/20 0.46
ALDH1A1 P00352 3/20 0.46
CYP1A2 P05177 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
KDM4E B2RXH2 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
MAPT P10636 1/20 0.46
CYP2C9 P11712 1/20 0.46
ESR1 P03372 6/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
TSHR P16473 2/20 0.42
CA12 O43570 2/20 0.42
CA9 Q16790 2/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
GLA P06280 1/20 0.42

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
SCHEMBL23789720 0.94 MMP3 (0.52) ACHECYP2C19ALDH1A1CYP1A2TDP1
SCHEMBL8279198 0.94 MMP3 (0.52) ACHECYP2C19ALDH1A1CYP1A2TDP1
SCHEMBL13879196 0.94 MMP3 (0.52) ACHECYP2C19ALDH1A1CYP1A2TDP1
SCHEMBL8279203 0.94 MMP3 (0.52) ACHECYP2C19ALDH1A1CYP1A2TDP1
Phenol SCHEMBL11507438 0.93 ACHE (0.52) ACHECYP2C19ALDH1A1CYP1A2TDP1
SCHEMBL347583 0.91 ACHE (0.68) ACHECYP2C19ALDH1A1CYP1A2TDP1
SCHEMBL3743294 0.91 ACHE (0.68) ACHECYP2C19ALDH1A1CYP1A2TDP1
SCHEMBL28032007 0.91 ACHE (0.68) ACHECYP2C19ALDH1A1CYP1A2TDP1
SCHEMBL14173660 0.90 MMP3 (0.58) ACHECYP2C19ALDH1A1TDP1MAPT
SCHEMBL22182772 0.90 MMP3 (0.58) ACHECYP2C19ALDH1A1TDP1MAPT

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
US-20210277176-A1 FORMULATION CONTAINING A HIGHLY BRANCHED POLYMER, HIGHLY BRANCHED POLYMER AND ELECTRO-OPTICAL DEVICE CONTAINING THIS HIGHLY BRANCHED POLYMER MERCK PATENT GMBH (DE) 2021-09-09 US disclosed
EP-1205808-B1 Electrophotographic photoreceptor and method of preparation thereof and image forming method and apparatus using the photoreceptor RICOH KK (JP) 2010-03-17 EP disclosed
US-6099996-A FIRST CHARGE TRANSPORTING LAYER CONSISTS OF AROMATIC AMINE AND SECOND CHARGE TRANSPORTING LAYER CONTAINING AROMATIC AMINE WITH ARYLESTER GROUP XEROX CORPORATION (US) 2000-08-08 US disclosed