SCHEMBL21085136

SCHEMBL21085136

O=C(O)C1C(O)C[CH]CC1O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.40
TDP1 Q9NUW8 3/20 0.40
APEX1 P27695 1/20 0.40
CTDSP1 Q9GZU7 1/20 0.36
LMNA P02545 3/20 0.35
PMP22 Q01453 2/20 0.35
TSHR P16473 2/20 0.35
KDM4E B2RXH2 1/20 0.35
GMNN O75496 1/20 0.35
TFPI2 P48307 1/20 0.35
TP53 P04637 1/20 0.35
NFKB1 P19838 1/20 0.35
THPO P40225 1/20 0.35
CYP2D6 P10635 2/20 0.33
CYP1A2 P05177 2/20 0.33
CYP2C19 P33261 2/20 0.33
BLM P54132 2/20 0.33
GRM6 O15303 2/20 0.33
GRM2 Q14416 2/20 0.33
GRM3 Q14832 2/20 0.33

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
SCHEMBL28285592 0.73 TDP1 (0.46) POLBTDP1APEX1CTDSP1LMNA
SCHEMBL1144503 0.71
SCHEMBL16569728 0.71
SCHEMBL21085048 0.70 GRM5 (0.35) POLBTDP1APEX1CTDSP1LMNA
SCHEMBL23339502 0.69 POLB (0.42) POLBTDP1APEX1LMNAPMP22
SCHEMBL11235070 0.69 TDP1 (0.41) POLBTDP1APEX1CTDSP1LMNA
SCHEMBL4433601 0.67 POLB (0.54) POLBTDP1APEX1CTDSP1LMNA
SCHEMBL4433599 0.67 POLB (0.54) POLBTDP1APEX1CTDSP1LMNA
SCHEMBL5966268 0.67
SCHEMBL21085103 0.67 POLB (0.36) POLBTDP1APEX1CTDSP1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10759749-B2 Therapeutic agent for diabetes JCR PHARMACEUTICALS CO., LTD. (JP) 2020-09-01 US disclosed
EP-3508474-A1 NOVEL THERAPEUTIC AGENT FOR DIABETES JCR Pharmaceuticals Co., Ltd. (JP) 2019-07-10 EP disclosed
US-20190202781-A1 NOVEL THERAPEUTIC AGENT FOR DIABETES JCR PHARMACEUTICALS CO., LTD. (JP) 2019-07-04 US 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-20190202781-A1 NOVEL THERAPEUTIC AGENT FOR DIABETES GPR119, IAPP, DPP4 POLB 4516/4885TDP1 3697/4885APEX1 4631/4885
US-10759749-B2 Therapeutic agent for diabetes GPR119, IAPP, DPP4 POLB 4316/4885TDP1 2736/4885APEX1 4520/4885

“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.