SCHEMBL28375511

SCHEMBL28375511

Cc1ccc(CC(=O)NCCC2=CCCCC2)cc1

nearest known ligand 0.78

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.78
▸ HPGD P15428 5/20 0.78
▸ HTT P42858 3/20 0.70
▸ MAPT P10636 3/20 0.70
▸ MEN1 O00255 3/20 0.63
▸ KMT2A Q03164 3/20 0.63
▸ NPC1 O15118 1/20 0.63
▸ RAB9A P51151 1/20 0.63
▸ SMN1; SMN2 Q16637 1/20 0.63
▸ TP53 P04637 1/20 0.59
▸ NPSR1 Q6W5P4 2/20 0.59
▸ LMNA P02545 1/20 0.59
▸ TDP1 Q9NUW8 1/20 0.59
▸ L3MBTL1 Q9Y468 1/20 0.57
▸ POLB P06746 1/20 0.56

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
SCHEMBL6544386 0.86 ALDH1A1 (1.00) ALDH1A1HPGDMAPTMEN1KMT2A
SCHEMBL11366660 0.81 ALDH1A1 (0.81) ALDH1A1HPGDMEN1KMT2ANPSR1
SCHEMBL12717314 0.76 SMN1; SMN2 (0.64) ALDH1A1HPGDHTTMAPTNPC1
SCHEMBL7783342 0.76 EPHX1 (0.73) ALDH1A1HPGDHTTMAPTKMT2A
SCHEMBL23004911 0.76 HTT (0.56) ALDH1A1HPGDHTTMAPTMEN1
SCHEMBL28226345 0.76 HPGD (0.72) ALDH1A1HPGDHTTMEN1KMT2A
SCHEMBL3454940 0.74 TDP1 (0.73) ALDH1A1HPGDMAPTRAB9ASMN1; SMN2
SCHEMBL21391252 0.74 HPGD (0.83) ALDH1A1HPGDMAPTMEN1KMT2A
SCHEMBL15695713 0.74 ALDH1A1 (0.67) ALDH1A1HPGDHTTMAPTKMT2A
SCHEMBL13332523 0.74 EPHX2 (0.79) ALDH1A1HPGDMEN1KMT2ANPC1

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
CN-110627672-B Preparation method of dimemorfan phosphate and intermediate thereof 广东东阳光药业有限公司 2023-01-31 — — CN claimed
CN-110627672-A Preparation method of dimemorfan phosphate and intermediate thereof 广东东阳光药业有限公司 2019-12-31 — — CN claimed
CN-110627672-B Preparation method of dimemorfan phosphate and intermediate thereof 广东东阳光药业有限公司 2023-01-31 — — CN disclosed
CN-110627672-B Preparation method of dimemorfan phosphate and intermediate thereof 广东东阳光药业有限公司 2023-01-31 — — CN disclosed
CN-110627672-A Preparation method of dimemorfan phosphate and intermediate thereof 广东东阳光药业有限公司 2019-12-31 — — CN disclosed
CN-110627672-A Preparation method of dimemorfan phosphate and intermediate thereof 广东东阳光药业有限公司 2019-12-31 — — CN disclosed
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