SCHEMBL16466706

SCHEMBL16466706

O=C1C(O)OCCN1Cc1ccccc1C(F)(F)F

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ SIRT2 Q8IXJ6 1/20 0.47
▸ SIRT1 Q96EB6 1/20 0.47
▸ KMT2A Q03164 3/20 0.45
▸ TRPC5 Q9UL62 2/20 0.44
▸ KDM4E B2RXH2 7/20 0.44
▸ ALDH1A1 P00352 6/20 0.44
▸ ATM Q13315 3/20 0.44
▸ TDP1 Q9NUW8 4/20 0.43
▸ NPSR1 Q6W5P4 3/20 0.43
▸ GAA P10253 1/20 0.43
▸ TSHR P16473 1/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ C5AR1 P21730 2/20 0.42
▸ HSD11B1 P28845 1/20 0.42
▸ KCNH2 Q12809 1/20 0.41
▸ TRPC4 Q9UBN4 1/20 0.41
▸ RECQL P46063 1/20 0.41
▸ COMT P21964 1/20 0.41

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
SCHEMBL16589760 0.85 NPSR1 (0.45) SIRT2SIRT1KMT2ATRPC5KDM4E
SCHEMBL16467037 0.80 CYP1A2 (0.50) SIRT2SIRT1ALDH1A1TSHRKCNH2
SCHEMBL16467013 0.77 SIRT2 (0.47) SIRT2SIRT1ALDH1A1NPSR1TSHR
SCHEMBL12208454 0.76 TACR1 (0.51) KMT2AGAAMEN1
SCHEMBL16467001 0.76 SIRT2 (0.44) SIRT2SIRT1KDM4EALDH1A1HSD11B1
SCHEMBL16466757 0.76 SIRT2 (0.48) SIRT2SIRT1KMT2AKDM4EALDH1A1
SCHEMBL24719122 0.75 KMT2A (0.48) SIRT2SIRT1KMT2ATRPC5KDM4E
SCHEMBL28800652 0.74 KDM4E (0.43) SIRT2SIRT1KMT2AKDM4EALDH1A1
SCHEMBL4328665 0.74 P2RX7 (0.43) —
SCHEMBL12142176 0.73 KDM4E (0.47) SIRT2SIRT1KMT2ATRPC5KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2837624-B1 4-SUBSTITUENT-2-HYDROXYLMORPHOLINE-3-ONE AND PREPARATION METHOD THEREOF ZHEJIANG HISUN PHARM CO LTD (CN) 2018-06-27 — — EP disclosed
EP-2837624-B1 4-SUBSTITUENT-2-HYDROXYLMORPHOLINE-3-ONE AND PREPARATION METHOD THEREOF ZHEJIANG HISUN PHARM CO LTD (CN) 2018-06-27 — — EP disclosed
US-9676736-B2 4-substituent-2-hydroxylmorpholine-3-one and preparation method thereof ZHEJIANG HISUN PHARMACEUTICAL CO., LTD. (CN) 2017-06-13 — — US disclosed
US-9676736-B2 4-substituent-2-hydroxylmorpholine-3-one and preparation method thereof ZHEJIANG HISUN PHARMACEUTICAL CO., LTD. (CN) 2017-06-13 — — US disclosed
US-20150087828-A1 4-SUBSTITUENT-2-HYDROXYLMORPHOLINE-3-ONE AND PREPARATION METHOD THEREOF ZHEJIANG HISUN PHARMACEUTICAL CO., LTD. (CN) 2015-03-26 — — US disclosed
US-20150087828-A1 4-SUBSTITUENT-2-HYDROXYLMORPHOLINE-3-ONE AND PREPARATION METHOD THEREOF ZHEJIANG HISUN PHARMACEUTICAL CO., LTD. (CN) 2015-03-26 — — US disclosed
EP-2837624-A1 4-SUBSTITUENT-2-HYDROXYLMORPHOLINE-3-ONE AND PREPARATION METHOD THEREOF Zhejiang Hisun Pharmaceutical Co. Ltd. (CN) 2015-02-18 — — EP disclosed
EP-2837624-A1 4-SUBSTITUENT-2-HYDROXYLMORPHOLINE-3-ONE AND PREPARATION METHOD THEREOF Zhejiang Hisun Pharmaceutical Co. Ltd. (CN) 2015-02-18 — — EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150087828-A1 4-SUBSTITUENT-2-HYDROXYLMORPHOLINE-3-ONE AND PREPARATION METHOD THEREOF OPRK1, HTR3C, HTR3A SIRT2 3548/4885SIRT1 3058/4885KMT2A 1542/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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