SCHEMBL22153065

SCHEMBL22153065

Cc1cnc(N2CC(OS(C)(=O)=O)C2)cc1C#N

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 1/20 0.36
▸ TBK1 Q9UHD2 1/20 0.36
▸ SMO Q99835 1/20 0.35
▸ AR P10275 3/20 0.34
▸ RET P07949 3/20 0.34
▸ KDM4E B2RXH2 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ RIPK1 Q13546 1/20 0.33
▸ PDE9A O76083 1/20 0.32
▸ NR1H2 P55055 1/20 0.32
▸ NR1H3 Q13133 1/20 0.32
▸ CHRNB2 P17787 5/20 0.32
▸ CHRNB4 P30926 5/20 0.32
▸ CHRNA3 P32297 5/20 0.32
▸ CHRNA4 P43681 5/20 0.32
▸ KCNH2 Q12809 1/20 0.32
▸ GPR119 Q8TDV5 1/20 0.32

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
SCHEMBL23955998 0.83 EGLN2 (0.39) ARRETCHRNB2CHRNB4CHRNA3
SCHEMBL22129420 0.81 SMO (0.39) SMO
SCHEMBL22153061 0.80 PDE9A (0.41) TBK1SMOARRETKDM4E
SCHEMBL28939074 0.77 GPR119 (0.52) JAK2KDM4EALDH1A1GPR119
SCHEMBL22129389 0.77 RET (0.37) SMOARRETKDM4EALDH1A1
SCHEMBL17559324 0.73 GPR119 (0.48) SMOSMN1; SMN2GPR119
SCHEMBL23044984 0.73 MCHR1 (0.33) SMOKCNH2
SCHEMBL22152251 0.69 GPR119 (0.49) SMOGPR119
SCHEMBL19145260 0.69 ALDH1A1 (0.51) TBK1ARRETKDM4EALDH1A1
SCHEMBL23057532 0.67 ACACB (0.49) GPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111333626-B Phenyl pyrrolidine compounds and uses thereof 武汉人福创新药物研发中心有限公司 2022-10-18 — — CN disclosed
US-20220056014-A1 PHENYLPYRROLIDINE COMPOUND AND USE THEREOF Wuhan Humanwell Innovative Drug Research and Development Center Limited Company (CN) 2022-02-24 — — US disclosed
EP-3901146-A1 PHENYLPYRROLIDINE COMPOUND AND USE THEREOF Wuhan Humanwell Innovative Drug Research and Development Center Limited Company (CN) 2021-10-27 — — EP disclosed
EP-3901146-A1 PHENYLPYRROLIDINE COMPOUND AND USE THEREOF Wuhan Humanwell Innovative Drug Research and Development Center Limited Company (CN) 2021-10-27 — — EP disclosed
CN-111333626-A Phenyl pyrrolidine compounds and uses thereof 湖北生物医药产业技术研究院有限公司 2020-06-26 — — CN disclosed
WO-2020125627-A1 PHENYLPYRROLIDINE COMPOUND AND USE THEREOF 湖北生物医药产业技术研究院有限公司 2020-06-25 — — WO disclosed
WO-2020125627-A1 PHENYLPYRROLIDINE COMPOUND AND USE THEREOF 湖北生物医药产业技术研究院有限公司 2020-06-25 — — WO 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-20220056014-A1 PHENYLPYRROLIDINE COMPOUND AND USE THEREOF PAH, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, AVPR2 JAK2 3035/4885TBK1 4225/4885SMO 4546/4885

“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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