SCHEMBL29924767

SCHEMBL29924767

CCc1ccccc1-c1ccc(CNC(=O)OC(C)(C)C)cc1F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 1/20 0.47
BRD9 Q9H8M2 1/20 0.44
BAZ2B Q9UIF8 1/20 0.44
BAZ2A Q9UIF9 1/20 0.44
GRM2 Q14416 1/20 0.44
NAMPT P43490 2/20 0.43
KDM4A O75164 1/20 0.43
HDAC1 Q13547 2/20 0.42
PTPN1 P18031 1/20 0.41
HDAC10 Q969S8 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
PDCD1 Q15116 1/20 0.41
CD274 Q9NZQ7 1/20 0.41
GLS O94925 3/20 0.41
BRD4 O60885 1/20 0.41
CREBBP Q92793 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
PDK2 Q15119 1/20 0.40
NSD2 O96028 1/20 0.40
CTSS P25774 1/20 0.40

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
SCHEMBL29925016 0.84 HDAC1 (0.52) BRD9BAZ2BBAZ2AGRM2NAMPT
SCHEMBL24999627 0.80 GRM2 (0.49) GRM2NAMPTKDM4AHDAC1GLS
SCHEMBL29769069 0.80 GRM2 (0.49) GRM2NAMPTKDM4AHDAC1GLS
SCHEMBL12231247 0.79 GRM2 (0.49) GRM2NAMPTKDM4AHDAC1GLS
SCHEMBL29924728 0.79 GRM2 (0.49) GRM2NAMPTKDM4AHDAC1GLS
SCHEMBL24822620 0.78 GRM2 (0.44) GRM2NAMPTKDM4AHDAC1L3MBTL1
SCHEMBL26828546 0.78 EPHX2 (0.42) KCNA5GRM2NAMPTKDM4AHDAC1
SCHEMBL29369357 0.77 HDAC1 (0.51) GRM2NAMPTKDM4AHDAC1L3MBTL1
SCHEMBL25470355 0.77 KCNA5 (0.52) KCNA5BRD9BAZ2BBAZ2AGRM2
SCHEMBL31738223 0.76 GRM2 (0.49) GRM2NAMPTKDM4AHDAC1GLS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4274569-A1 C-MYC MRNA TRANSLATION MODULATORS AND USES THEREOF IN THE TREATMENT OF CANCER Anima Biotech Inc. (US) 2023-11-15 EP disclosed
WO-2022150316-A1 C-MYC MRNA TRANSLATION MODULATORS AND USES THEREOF IN THE TREATMENT OF CANCER ANIMA BIOTECH INC. (US) 2022-07-14 WO disclosed