SCHEMBL28639965

SCHEMBL28639965

O=CNOC(=O)C1(c2ccc(Cl)cc2)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC4 P56524 1/20 0.46
▸ HSD11B1 P28845 7/20 0.45
▸ OPRM1 P35372 1/20 0.44
▸ ALDH1A1 P00352 4/20 0.43
▸ SMN1; SMN2 Q16637 4/20 0.43
▸ KDM4E B2RXH2 1/20 0.42
▸ GAA P10253 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ MAPT P10636 4/20 0.41
▸ LMNA P02545 4/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ THRB P10828 1/20 0.40
▸ TET3 O43151 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ FBXL19 Q6PCT2 1/20 0.40
▸ CXXC5 Q7LFL8 1/20 0.40
▸ KDM2B Q8NHM5 1/20 0.40
▸ CXXC4 Q9H2H0 1/20 0.40
▸ KDM2A Q9Y2K7 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
SCHEMBL349454 0.78 ALDH1A1 (0.55) HDAC4HSD11B1OPRM1ALDH1A1SMN1; SMN2
SCHEMBL2097060 0.74 HSD11B1 (0.58) HDAC4HSD11B1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL2321833 0.72 HDAC4 (0.58) HDAC4HSD11B1OPRM1ALDH1A1SMN1; SMN2
SCHEMBL4939286 0.72 HDAC4 (0.63) HDAC4HSD11B1OPRM1ALDH1A1SMN1; SMN2
SCHEMBL2321735 0.72 HSD11B1 (0.59) HDAC4HSD11B1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL5639097 0.71 HDAC4 (0.61) HDAC4HSD11B1OPRM1ALDH1A1SMN1; SMN2
SCHEMBL3554737 0.70 HSD11B1 (0.58) HDAC4HSD11B1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL75310 0.70 TET3 (0.61) HDAC4HSD11B1TET3KMT2AFBXL19
SCHEMBL653528 0.69 DRD2 (0.51) HDAC4OPRM1ALDH1A1SMN1; SMN2MAPT
SCHEMBL11629543 0.69 OPRM1 (0.47) HDAC4HSD11B1OPRM1ALDH1A1SMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113317322-B Soluble solution containing aryl formamide cyclopropanecarboxylic acid and preparation method thereof 郑州郑氏化工产品有限公司 2022-04-05 — — CN claimed
CN-113317322-A Soluble solution containing aryl formamide cyclopropanecarboxylic acid and preparation method thereof 郑州郑氏化工产品有限公司 2021-08-31 — — CN claimed
CN-113317322-B Soluble solution containing aryl formamide cyclopropanecarboxylic acid and preparation method thereof 郑州郑氏化工产品有限公司 2022-04-05 — — CN disclosed
CN-113317322-A Soluble solution containing aryl formamide cyclopropanecarboxylic acid and preparation method thereof 郑州郑氏化工产品有限公司 2021-08-31 — — CN disclosed
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