SCHEMBL28049079

SCHEMBL28049079

COc1ccc([PH](=O)C(=O)c2c(C)cccc2C)c(OC)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.44
MAPT P10636 5/20 0.44
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
GAA P10253 1/20 0.42
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPC1 O15118 3/20 0.39
RAB9A P51151 2/20 0.39
ABCG2 Q9UNQ0 4/20 0.39
CYP1A1 P04798 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2E1 P05181 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C8 P10632 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2A6 P11509 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP4B1 P13584 1/20 0.39
CYP2B6 P20813 1/20 0.39

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
SCHEMBL28049109 0.89 ALDH1A1 (0.40) ALDH1A1MAPTMEN1KMT2AGAA
SCHEMBL27928534 0.85 ABCG2 (0.43) ALDH1A1MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL28061700 0.82 CA12 (0.43) ALDH1A1MAPTMEN1KMT2AGAA
SCHEMBL28049080 0.78 NPC1 (0.41) ALDH1A1MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL28049123 0.76 PLA2G4B (0.43)
SCHEMBL9355708 0.75 CA12 (0.52) ALDH1A1MAPTMEN1KMT2AGAA
SCHEMBL710802 0.74 ABCB1 (0.44) ALDH1A1MAPTMEN1KMT2AGAA
SCHEMBL5994251 0.74 RAB9A (0.51) MAPTMEN1KMT2AHTTSMN1; SMN2
SCHEMBL7188255 0.73 MAPT (0.40) MAPTMEN1KMT2AGAAHTT
SCHEMBL9838566 0.71 CA12 (0.56) ALDH1A1MAPTMEN1KMT2AHTT

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-105164216-B Inkjet ink composition, ink jet recording method, ink group, decoration sheet and molding, mould internal shaping product and its manufacture method 富士胶片株式会社 2017-09-22 CN disclosed
CN-105980490-B Radiation-curable inkjet ink set and inkjet recording method 富士胶片株式会社 2017-06-30 CN disclosed
CN-105980490-A Radiation-curable inkjet ink set and inkjet recording method 富士胶片株式会社 2016-09-28 CN disclosed
CN-105462307-A Undercoat composition, composition set, inkjet recording method, and printed material FUJIFILM CORP 2016-04-06 CN disclosed
CN-105415883-A Inkjet Recording Method, And Printed Material FUJIFILM CORP 2016-03-23 CN disclosed
CN-105164216-A Ink jet ink composition, ink jet recording method, ink set, decorative sheet, decorative sheet molded product, method for producing in-mold molded article, and in-mold molded article FUJIFILM CORP 2015-12-16 CN disclosed