SCHEMBL29698165

SCHEMBL29698165

CC(O)CCOC(=O)N1CCc2ccccc2C1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PRMT5 O14744 10/20 0.59
▸ WDR77 Q9BQA1 10/20 0.59
▸ ACE P12821 2/20 0.53
▸ NOTUM Q6P988 1/20 0.52
▸ ABHD6 Q9BV23 1/20 0.52
▸ HRH3 Q9Y5N1 1/20 0.50
▸ MEN1 O00255 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ HPGD P15428 2/20 0.48
▸ TSHR P16473 1/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ HSD17B10 Q99714 1/20 0.48
▸ MAPT P10636 1/20 0.48
▸ TAAR1 Q96RJ0 1/20 0.48

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
SCHEMBL30023801 0.83 NOTUM (0.58) PRMT5WDR77ACENOTUMABHD6
SCHEMBL15355424 0.82 PRMT5 (0.67) PRMT5WDR77ACENOTUMABHD6
SCHEMBL16268868 0.82 ALDH1A1 (0.64) PRMT5WDR77ACENOTUMABHD6
SCHEMBL30647004 0.81 PRMT5 (0.55) PRMT5WDR77ACENOTUMABHD6
SCHEMBL15355387 0.81 PRMT5 (0.55) PRMT5WDR77ACENOTUMABHD6
SCHEMBL9527451 0.81 PRMT5 (0.57) PRMT5WDR77ACENOTUMABHD6
SCHEMBL9853000 0.80 SMN1; SMN2 (0.58) PRMT5WDR77NOTUMABHD6MEN1
SCHEMBL3721168 0.79 PRMT5 (0.56) PRMT5WDR77NOTUMABHD6HRH3
SCHEMBL22032274 0.79 PRMT5 (0.61) PRMT5WDR77NOTUMABHD6MEN1
SCHEMBL324836 0.78 PRMT5 (0.55) PRMT5WDR77NOTUMABHD6MEN1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116829555-A Protein tyrosine phosphatase inhibitors and methods of use thereof 卡里科生命科学有限责任公司 2023-09-29 — — CN disclosed
CN-116332873-A Protein tyrosine phosphatase inhibitors and methods of use thereof 卡里科生命科学有限责任公司 2023-06-27 — — CN disclosed
CN-114025844-B Protein tyrosine phosphatase inhibitors and methods of use thereof 卡里科生命科学有限责任公司 2022-07-26 — — CN disclosed
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