SCHEMBL22065474

SCHEMBL22065474

O=Cc1ccc(OCCOCCOCCOCC2CO2)cc1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.44
MAPT P10636 5/20 0.44
HPGD P15428 4/20 0.44
LMNA P02545 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
PKM P14618 2/20 0.44
GAA P10253 1/20 0.44
KDM4E B2RXH2 2/20 0.43
TDP1 Q9NUW8 1/20 0.42
TSHR P16473 4/20 0.41
TP53 P04637 3/20 0.41
HIF1A Q16665 2/20 0.41
MEN1 O00255 1/20 0.41
CYP1A2 P05177 1/20 0.41
KMT2A Q03164 1/20 0.41
PPARG P37231 1/20 0.41
CYP3A4 P08684 1/20 0.38

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
SCHEMBL9325190 0.86 TDP1 (0.55) ALDH1A1MAPTHPGDLMNASMN1; SMN2
SCHEMBL3466095 0.84 ALDH1A1 (0.60) ALDH1A1MAPTHPGDLMNASMN1; SMN2
SCHEMBL8105528 0.84 ALDH1A1 (0.60) ALDH1A1MAPTHPGDLMNASMN1; SMN2
SCHEMBL7694361 0.84 ALDH1A1 (0.60) ALDH1A1MAPTHPGDLMNASMN1; SMN2
SCHEMBL8371513 0.82 ALDH1A1 (0.59) ALDH1A1MAPTHPGDLMNASMN1; SMN2
SCHEMBL8104626 0.81 ALDH1A1 (0.49) ALDH1A1MAPTHPGDLMNASMN1; SMN2
SCHEMBL195029 0.81 TDP1 (0.47) ALDH1A1MAPTHPGDLMNASMN1; SMN2
SCHEMBL2829822 0.81 TDP1 (0.50) ALDH1A1MAPTHPGDLMNASMN1; SMN2
SCHEMBL2719932 0.81 TDP1 (0.50) ALDH1A1MAPTHPGDLMNASMN1; SMN2
SCHEMBL6859214 0.81 TDP1 (0.63) ALDH1A1MAPTHPGDLMNASMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12030774-B2 Surface-modified inorganic nitride, composition, thermally conductive material, and device with thermally conductive layer FUJIFILM CORPORATION (JP) 2024-07-09 US disclosed
US-20200180957-A1 SURFACE-MODIFIED INORGANIC NITRIDE, COMPOSITION, THERMALLY CONDUCTIVE MATERIAL, AND DEVICE WITH THERMALLY CONDUCTIVE LAYER FUJIFILM CORPORATION (JP) 2020-06-11 US disclosed