SCHEMBL22729349

SCHEMBL22729349

CC(C)(NC(=O)OCc1ccccc1)C(=O)NCCN1CCCC1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.49
OPRK1 P41145 3/20 0.46
LMNA P02545 2/20 0.46
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
POLB P06746 1/20 0.45
FKBP1A P62942 2/20 0.45
ITGB3 P05106 1/20 0.45
ITGA2B P08514 1/20 0.45
CTSS P25774 2/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
HTT P42858 1/20 0.43

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
SCHEMBL22729330 0.85 DPP4 (0.43) LMNAMEN1KMT2AFKBP1ACTSS
SCHEMBL20718021 0.83 SMN1; SMN2 (0.58) CYP3A4OPRK1LMNAMEN1KMT2A
SCHEMBL29861096 0.82 SMN1; SMN2 (0.50) LMNAMEN1KMT2APOLBCTSS
SCHEMBL4187465 0.82 SMN1; SMN2 (0.50) LMNAMEN1KMT2APOLBCTSS
SCHEMBL2188227 0.81 ITGB3 (0.47) OPRK1MEN1KMT2AFKBP1AITGB3
SCHEMBL2187323 0.80 ITGB3 (0.47) OPRK1MEN1KMT2AFKBP1AITGB3
SCHEMBL2186839 0.80 ITGB3 (0.47) OPRK1MEN1KMT2AFKBP1AITGB3
SCHEMBL7159219 0.79 LMNA (0.63) LMNAMEN1KMT2ASMN1; SMN2HTT
SCHEMBL4371451 0.79 MEN1 (0.59) CYP3A4OPRK1LMNAMEN1KMT2A
SCHEMBL17371252 0.79 MEN1 (0.49) LMNAMEN1KMT2ACTSSRAB9A

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-111630058-B Glucopyranosyl derivative and use thereof 广东东阳光药业有限公司 2022-02-15 CN disclosed
US-11186602-B2 Glucopyranosyl derivative and use thereof SUNSHINE LAKE PHARMA CO., LTD. (CN) 2021-11-30 US disclosed
US-20210054013-A1 GLUCOPYRANOSYL DERIVATIVE AND USE THEREOF SUNSHINE LAKE PHARMA CO., LTD. (CN) 2021-02-25 US disclosed
EP-3747892-A1 GLUCOPYRANOSYL DERIVATIVE AND USE THEREOF Sunshine Lake Pharma Co., Ltd. (CN) 2020-12-09 EP disclosed
EP-3747892-A1 GLUCOPYRANOSYL DERIVATIVE AND USE THEREOF Sunshine Lake Pharma Co., Ltd. (CN) 2020-12-09 EP disclosed
CN-111630058-A Glucopyranosyl derivative and use thereof 广东东阳光药业有限公司 2020-09-04 CN 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 (2 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-11186602-B2 Glucopyranosyl derivative and use thereof SLC5A1, SLC5A2, UGGT1 CYP3A4 616/4885OPRK1 2644/4885LMNA 4511/4885
US-20210054013-A1 GLUCOPYRANOSYL DERIVATIVE AND USE THEREOF SLC5A1, SLC5A2, UGGT1 CYP3A4 616/4885OPRK1 2644/4885LMNA 4511/4885

“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.