SCHEMBL10516619

SCHEMBL10516619

CCOC(C)Oc1ccc(C=O)cc1OC(C)OCC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 12/20 0.47
TSHR P16473 1/20 0.47
FDPS P14324 1/20 0.45
TACR2 P21452 1/20 0.43
HPGD P15428 3/20 0.40
TDP1 Q9NUW8 3/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
MAPT P10636 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
AOX1 Q06278 1/20 0.40
TRIM24 O15164 1/20 0.40
ALDH5A1 P51649 1/20 0.40
ABAT P80404 1/20 0.40
TRIM33 Q9UPN9 1/20 0.40
ALDH1A3 P47895 1/20 0.40
KDM4E B2RXH2 1/20 0.39
TTR P02766 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
LMNA P02545 1/20 0.38
HTT P42858 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
SCHEMBL22572791 0.92 ALDH1A1 (0.55) ALDH1A1TSHRFDPSTACR2HPGD
SCHEMBL8189179 0.84 TRPA1 (0.40) ALDH1A1TDP1MAPTLMNA
SCHEMBL28115845 0.82 ALDH3A1 (0.49) ALDH1A1HPGDMAPTALDH5A1ABAT
SCHEMBL4990024 0.81 ALDH1A1 (0.49) ALDH1A1TSHRFDPSTACR2HPGD
SCHEMBL26018351 0.80 TRPA1 (0.37) ALDH1A1TSHRMAPTALDH1A3LMNA
SCHEMBL1713698 0.79 ALDH1A1 (0.57) ALDH1A1TSHRFDPSHPGDTDP1
SCHEMBL3858045 0.78 ALDH1A3 (0.45) ALDH1A1HPGDMAPTALDH1A3SMN1; SMN2
SCHEMBL8337904 0.78 ALDH1A3 (0.61) ALDH1A1HPGDMAPTALDH1A3KDM4E
SCHEMBL24804114 0.78 TRPA1 (0.36) ALDH1A1MAPT
SCHEMBL30180722 0.77 ALDH1A1 (0.47) ALDH1A1TSHRFDPSTACR2HPGD

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-11327399-B2 Photoresist composition and process for producing photoresist pattern SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2022-05-10 US disclosed
EP-0304954-A2 Cyclic dipeptide enantiomers ICI AUSTRALIA LIMITED (AU) 1989-03-01 EP disclosed