SCHEMBL21969520

SCHEMBL21969520

O=Cc1ccc2ccc3c(OCC(=O)O)ccc4ccc1c2c43

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 3/20 0.53
KDM4E B2RXH2 5/20 0.45
TDP1 Q9NUW8 3/20 0.45
ALDH1A1 P00352 3/20 0.45
HPGD P15428 2/20 0.45
POLB P06746 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
TSHR P16473 1/20 0.42
CTDSP1 Q9GZU7 1/20 0.42
CASP1 P29466 1/20 0.39
PPARG P37231 1/20 0.39
CASP7 P55210 1/20 0.39
NCOA2 Q15596 1/20 0.39
NCOA1 Q15788 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
HSD17B10 Q99714 1/20 0.39
NCOA3 Q9Y6Q9 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.37
GLA P06280 1/20 0.37
PKM P14618 1/20 0.37

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
SCHEMBL21971926 0.82 CNR2 (0.44) PTGDR2TSHRMEN1KMT2A
SCHEMBL667406 0.81 KDM4E (0.63) PTGDR2KDM4ETDP1ALDH1A1HPGD
SCHEMBL29440259 0.81 KDM4E (0.63) PTGDR2KDM4ETDP1ALDH1A1HPGD
SCHEMBL21969518 0.81 IDO1 (0.41) PTGDR2KDM4ETDP1ALDH1A1HPGD
SCHEMBL2649228 0.80 PTGDR2 (0.66) PTGDR2KDM4ETDP1ALDH1A1HPGD
SCHEMBL10560500 0.80 LMNA (0.42) KDM4ETDP1ALDH1A1HPGDL3MBTL1
SCHEMBL9472877 0.78 NPC1 (0.56) KDM4ETDP1ALDH1A1HPGDPOLB
SCHEMBL21970138 0.78 HTR1B (0.41) PTGDR2KDM4ETDP1ALDH1A1HPGD
SCHEMBL21969519 0.78 SMN1; SMN2 (0.39) PTGDR2TDP1ALDH1A1HPGDL3MBTL1
SCHEMBL10051547 0.75 TDP1 (0.44) PTGDR2KDM4ETDP1ALDH1A1HPGD

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
US-11370950-B2 Surface-modified inorganic nitride, composition, thermally conductive material, and device with thermally conductive layer FUJIFILM CORPORATION (JP) 2022-06-28 US disclosed
EP-3653574-B1 SURFACE-MODIFIED INORGANIC NITRIDE, COMPOSITION, THERMALLY CONDUCTIVE MATERIAL, DEVICE PROVIDED WITH THERMALLY CONDUCTIVE LAYER FUJIFILM CORP (JP) 2021-01-06 EP disclosed
EP-3653573-A1 SURFACE-MODIFIED INORGANIC NITRIDE, COMPOSITION, THERMALLY CONDUCTIVE MATERIAL, DEVICE PROVIDED WITH THERMALLY CONDUCTIVE LAYER FUJIFILM Corporation (JP) 2020-05-20 EP disclosed
EP-3653574-A1 SURFACE-MODIFIED INORGANIC NITRIDE, COMPOSITION, THERMALLY CONDUCTIVE MATERIAL, DEVICE PROVIDED WITH THERMALLY CONDUCTIVE LAYER FUJIFILM Corporation (JP) 2020-05-20 EP disclosed
US-20200140738-A1 SURFACE-MODIFIED INORGANIC NITRIDE, COMPOSITION, THERMALLY CONDUCTIVE MATERIAL, AND DEVICE WITH THERMALLY CONDUCTIVE LAYER FUJIFILM CORPORATION (JP) 2020-05-07 US disclosed
US-20200140275-A1 SURFACE-MODIFIED INORGANIC NITRIDE, COMPOSITION, THERMALLY CONDUCTIVE MATERIAL, AND DEVICE WITH THERMALLY CONDUCTIVE LAYER FUJIFILM CORPORATION (JP) 2020-05-07 US disclosed