SCHEMBL21645205

SCHEMBL21645205

CC1CC(O)CN(C(=O)O)C1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PLA2G1B P04054 1/20 0.39
ATG4B Q9Y4P1 1/20 0.39
ATM Q13315 1/20 0.38
GAA P10253 1/20 0.38
VNN1 O95497 1/20 0.36
HPGD P15428 2/20 0.35
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 3/20 0.34
KDM4E B2RXH2 2/20 0.34
PIK3CD O00329 1/20 0.32
TSHR P16473 1/20 0.32
LIPE Q05469 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
SCHEMBL2938449 0.86 PLA2G1B (0.47) PLA2G1BATG4BGAAHPGDKMT2A
SCHEMBL29105801 0.84 ATM (0.40) ATMPIK3CD
SCHEMBL29105799 0.84 ATM (0.40) ATMPIK3CD
SCHEMBL21339145 0.83 CHRNB2 (0.48) PLA2G1BATG4BATMGAAVNN1
SCHEMBL21339455 0.83 CHRNB2 (0.48) PLA2G1BATG4BATMGAAVNN1
SCHEMBL21339452 0.83 CHRNB2 (0.48) PLA2G1BATG4BATMGAAVNN1
SCHEMBL20207288 0.83 CHRNB2 (0.48) PLA2G1BATG4BATMGAAVNN1
SCHEMBL15006800 0.82 DPP4 (0.38) PLA2G1BATG4BGAAHPGDKMT2A
SCHEMBL12897446 0.81
SCHEMBL321905 0.78

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-116375789-B Antitumor compound, preparation method thereof, pharmaceutical composition and application 北京大学第一医院 2025-03-21 CN disclosed
CN-116375789-A Antitumor compound, preparation method thereof, pharmaceutical composition and application 北京大学第一医院 2023-07-04 CN disclosed
US-20210300940-A1 TLR7/8 ANTAGONISTS AND USES THEREOF MERCK PATENT GMBH (DE) 2021-09-30 US disclosed
EP-3830080-A1 TLR7/8 ANTAGONISTS AND USES THEREOF Merck Patent GmbH (DE) 2021-06-09 EP disclosed
CN-111630051-A Spirocyclic compounds of alkenes as farnesoid X receptor modulators 百时美施贵宝公司 2020-09-04 CN disclosed
WO-2020025517-A1 TLR7/8 ANTAGONISTS AND USES THEREOF MERCK PATENT GMBH (DE) 2020-02-06 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-20210300940-A1 TLR7/8 ANTAGONISTS AND USES THEREOF TLR7, TLR8, TLR9 PLA2G1B 1510/4885ATG4B 1613/4885ATM 975/4885

“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.