SCHEMBL7142190

SCHEMBL7142190

O=C(Nc1ccc(F)c([Ti])c1F)Oc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
ALDH1A1 P00352 9/20 0.45
CYP1A2 P05177 3/20 0.45
MAPT P10636 3/20 0.44
KDM4E B2RXH2 4/20 0.44
HPGD P15428 2/20 0.44
KMT2A Q03164 4/20 0.43
MEN1 O00255 3/20 0.43
RAD51 Q06609 1/20 0.43
GAA P10253 3/20 0.43
GLA P06280 1/20 0.43
ATM Q13315 1/20 0.43
TRPV1 Q8NER1 1/20 0.43
MAOB P27338 1/20 0.43
FAAH O00519 1/20 0.42
THRB P10828 1/20 0.41
GFER P55789 1/20 0.41
TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL29454267 0.82 NPC1 (0.52) NPC1RAB9ANPSR1ALDH1A1CYP1A2
SCHEMBL22069015 0.82 NPC1 (0.52) NPC1RAB9ANPSR1ALDH1A1CYP1A2
SCHEMBL1897287 0.80 NPC1 (0.69) NPC1RAB9ANPSR1ALDH1A1CYP1A2
SCHEMBL22069331 0.80 NPC1 (0.50) NPC1RAB9ANPSR1ALDH1A1CYP1A2
SCHEMBL29454288 0.79 NPC1 (0.49) NPC1RAB9ANPSR1ALDH1A1CYP1A2
SCHEMBL29739678 0.78 NPC1 (0.48) NPC1RAB9ANPSR1ALDH1A1CYP1A2
SCHEMBL10356846 0.78 RAB9A (0.81) NPC1RAB9ANPSR1ALDH1A1CYP1A2
SCHEMBL27468722 0.77 HDAC1 (0.55) NPC1RAB9AMAPTHPGDKMT2A
SCHEMBL21319206 0.77 RAB9A (0.60) NPC1RAB9ANPSR1ALDH1A1MAPT
SCHEMBL1890797 0.76 RAB9A (0.63) NPC1RAB9ANPSR1ALDH1A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1215379-C Original edition for lithographic printing plate FUJI PHOTO FILM CO LTD (JP) 2005-08-17 CN disclosed
CN-1171122-C Optical polymerism composition 富士胶片株式会社 2004-10-13 CN disclosed
US-20030190554-A1 Photopolymerization; development using alkalinity developer FUJIFILM CORPORATION (JP) 2003-10-09 US disclosed
CN-1425068-A Fungal transcriptional activator useful in methods of producing polypeptides NOVOZYMES AS (DK) 2003-06-18 CN disclosed
CN-1374559-A Original edition for lithographic printing plate FUJI PHOTO FILM CO LTD (JP) 2002-10-16 CN disclosed
CN-1319784-A Optical polymerism composition FUJI PHOTO FILM CO LTD (JP) 2001-10-31 CN disclosed