SCHEMBL6762235

SCHEMBL6762235

C=CC(=O)OC(=O)c1cccc(C)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.49
KMT2A Q03164 4/20 0.47
KDM4E B2RXH2 2/20 0.47
MAPK1 P28482 1/20 0.47
HDAC8 Q9BY41 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
MAPT P10636 3/20 0.46
ESR1 P03372 2/20 0.46
MEN1 O00255 2/20 0.46
POLB P06746 1/20 0.46
ESR2 Q92731 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.44
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
GAA P10253 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
ALDH1A1 P00352 2/20 0.43

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
SCHEMBL5482465 0.88 AKT1 (0.42) KMT2AKDM4EMAPK1MAPTESR1
SCHEMBL1249725 0.85 PARP1 (0.47) PARP1KMT2AKDM4EMAPK1HDAC8
SCHEMBL31316346 0.84 PARP1 (0.61) PARP1KMT2AKDM4EMAPK1HDAC8
SCHEMBL4188727 0.84 PARP1 (0.61) PARP1KMT2AKDM4EMAPK1HDAC8
SCHEMBL28477801 0.80 PBRM1 (0.47) KDM4EPOLBSMN1; SMN2NPC1CYP3A4
SCHEMBL715983 0.79 PARP1 (0.52) PARP1KMT2AKDM4EMAPK1HDAC8
SCHEMBL6763060 0.79 TDP1 (0.53) KMT2AHDAC6MAPTMEN1SMN1; SMN2
SCHEMBL2415700 0.79 PARP1 (0.55) PARP1KMT2AKDM4EMAPK1HDAC8
SCHEMBL6113333 0.79 SMN1; SMN2 (0.58) PARP1KMT2AHDAC8HDAC6MAPT
SCHEMBL1053277 0.78 AKT1 (0.54) KMT2AMAPK1MAPTPOLBSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109641395-B Photocurable support material composition for inkjet 3D printer, ink, and method for producing support material and photo-molded object 株式会社日本触媒 2021-03-30 CN claimed
WO-2023163144-A9 OPTICAL LAMINATE FOR OLED DISPLAY DEVICE 日東電工株式会社 2024-02-01 WO disclosed
WO-2023190079-A1 ADHESIVE SHEET FOR OPTICAL APPLICATIONS 日東電工株式会社 2023-10-05 WO disclosed
WO-2023190078-A1 ADHESIVE SHEET FOR OPTICAL APPLICATIONS 日東電工株式会社 2023-10-05 WO disclosed
US-6806042-B2 PHOTOGRAPHIC FILMS COMPRISNG SUPPORTS HAVING RED, GREEN AND BLUE SENSITIVE SILVER HALIDE EMULSIONS, AND CYAN, MAGENTA AND YELLOW COUPLERS RESPECTIVELY; IMAGES AGFA-GEVAERT (BE) 2004-10-19 US disclosed
US-20040023171-A1 Colour photographic print material AGFA-GEVAERT N.V. (BELGIUM) 2004-02-05 US disclosed
EP-1380893-A2 Colour photographic print material Agfa-Gevaert (BE) 2004-01-14 EP disclosed