SCHEMBL21243989

SCHEMBL21243989

CCN(CC)CCNC(=O)C(C)(C)N

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.46
LMNA P02545 2/20 0.46
ACHE P22303 2/20 0.46
SLC22A2 O15244 1/20 0.46
SLC22A1 O15245 1/20 0.46
TSHR P16473 1/20 0.46
MAPK1 P28482 1/20 0.46
CYP2C19 P33261 1/20 0.46
BLM P54132 2/20 0.45
PMP22 Q01453 1/20 0.45
KDM4E B2RXH2 1/20 0.44
HPGD P15428 1/20 0.44
KMT2A Q03164 1/20 0.42
EGFR P00533 1/20 0.40
NFKB1 P19838 1/20 0.40
KCNH2 Q12809 1/20 0.40
BCHE P06276 1/20 0.39
CYP3A4 P08684 2/20 0.39
POLB P06746 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39

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
Hydrochloric Acid SCHEMBL21222700 0.98 LMNA (0.47) ALDH1A1LMNAACHESLC22A2SLC22A1
SCHEMBL12388737 0.84 ALDH1A1 (0.45) ALDH1A1LMNAACHESLC22A2SLC22A1
SCHEMBL21018349 0.81 ALDH1A1 (0.42) ALDH1A1LMNAACHESLC22A2SLC22A1
SCHEMBL15741039 0.80 DNM1 (0.42) ALDH1A1MAPK1CYP2C19KDM4EKMT2A
SCHEMBL17664877 0.80 DRD2 (0.33) ALDH1A1LMNAACHESLC22A2SLC22A1
Hydrochloric Acid SCHEMBL21197522 0.78 DNM1 (0.41) ALDH1A1LMNAMAPK1CYP2C19KDM4E
SCHEMBL13887188 0.77 KDM4C (0.45) ALDH1A1KDM4EKMT2APOLBSMN1; SMN2
SCHEMBL24029802 0.76 CA14 (0.30)
SCHEMBL9602707 0.75 ALDH1A1 (0.51) ALDH1A1LMNAACHESLC22A2SLC22A1
SCHEMBL21017566 0.75 ALDH1A1 (0.39) ALDH1A1LMNAACHESLC22A2SLC22A1

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 9 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-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
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
WO-2019149178-A1 GLUCOPYRANOSYL DERIVATIVE AND USE THEREOF 广东东阳光药业有限公司 2019-08-08 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 (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 ALDH1A1 703/4885LMNA 4511/4885ACHE 3897/4885
US-20210054013-A1 GLUCOPYRANOSYL DERIVATIVE AND USE THEREOF SLC5A1, SLC5A2, UGGT1 ALDH1A1 703/4885LMNA 4511/4885ACHE 3897/4885

“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.