SCHEMBL2065327

SCHEMBL2065327

FN(CCN(F)c1ccccc1)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.40
CYP3A4 P08684 2/20 0.40
CYP2C9 P11712 2/20 0.40
CYP2C19 P33261 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
KDM4E B2RXH2 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
MAPT P10636 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
HTT P42858 3/20 0.39
NPSR1 Q6W5P4 2/20 0.36
ALOX15 P16050 1/20 0.36
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TSHR P16473 2/20 0.34
NPC1 O15118 1/20 0.34
POLB P06746 1/20 0.34
RAB9A P51151 1/20 0.34

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
SCHEMBL25415568 0.85 KDM4E (0.43) ALDH1A1CYP3A4CYP2C9CYP2C19TDP1
SCHEMBL9289298 0.85 TP53 (0.42) ALDH1A1CYP3A4CYP2C9CYP2C19TDP1
SCHEMBL7923729 0.83 TAAR1 (0.52) ALDH1A1ALOX15KCNH2
SCHEMBL10705258 0.81 TDP1 (0.44) ALDH1A1TDP1KDM4EMAPTHTT
SCHEMBL27705430 0.80 ALDH1A1 (0.39) ALDH1A1CYP3A4CYP2C9CYP2C19TDP1
SCHEMBL20221303 0.79 NPC1 (0.47) TDP1MAPTHTTNPSR1NPC1
SCHEMBL1634907 0.78 ALDH1A1 (0.46) ALDH1A1CYP3A4CYP2C9CYP2C19TDP1
SCHEMBL27781873 0.78 ALDH1A1 (0.37) ALDH1A1CYP3A4CYP2C9CYP2C19TDP1
SCHEMBL27611446 0.78 NPC1 (0.50) NPC1RAB9AKCNH2
SCHEMBL11021723 0.76 KDM4E (0.36) ALDH1A1CYP3A4CYP2C9CYP2C19TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120255898-A1 SEMIPERMEABLE POLYMERS AND METHOD FOR PRODUCING SAME ELTRON RESEARCH & DEVELOPMENT, INC. (US) 2012-10-11 US disclosed
US-8147735-B2 Semipermeable polymers and method for producing same ELTRON RESEARCH & DEVELOPMENT, INC. (US) 2012-04-03 US disclosed
WO-2010042250-A2 SEMIPERMEABLE POLYMERS AND METHOD FOR PRODUCING SAME ELTRON RESEARCH AND DEVELOPMENT, INC. (US) 2010-04-15 WO disclosed
US-20100006495-A1 SEMIPERMEABLE POLYMERS AND METHOD FOR PRODUCING SAME ELTRON RESEARCH AND DEVELOPMENT, INC. (US) 2010-01-14 US disclosed