SCHEMBL5801967

SCHEMBL5801967

O=C(O)OC(O)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.[CaH2]

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.50
PDE4A P27815 1/20 0.48
LMNA P02545 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
USP2 O75604 1/20 0.45
SLCO1B1 Q9Y6L6 1/20 0.45
KDM4E B2RXH2 2/20 0.34
OR51E2 Q9H255 1/20 0.31
MGAM O43451 1/20 0.30

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
SCHEMBL27740481 0.98 TDP1 (0.52) TDP1PDE4ALMNAL3MBTL1USP2
SCHEMBL1892968 0.96 TDP1 (0.50) TDP1PDE4ALMNAL3MBTL1USP2
SCHEMBL2122837 0.96 TDP1 (0.50) TDP1PDE4ALMNAL3MBTL1USP2
SCHEMBL27648828 0.89 PDE4A (0.48) TDP1PDE4ALMNAL3MBTL1USP2
SCHEMBL27844168 0.83 TDP1 (0.55) TDP1PDE4ALMNAL3MBTL1USP2
SCHEMBL2337822 0.83 TDP1 (0.55) TDP1PDE4ALMNAL3MBTL1USP2
SCHEMBL19951539 0.83 TDP1 (0.55) TDP1PDE4ALMNAL3MBTL1USP2
SCHEMBL2341187 0.83 TDP1 (0.55) TDP1PDE4ALMNAL3MBTL1USP2
SCHEMBL28448089 0.83 TDP1 (0.55) TDP1PDE4ALMNAL3MBTL1USP2
Water SCHEMBL27605931 0.82 TDP1 (0.48) TDP1PDE4ALMNAL3MBTL1USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017100656-A1 DRY POWDER FORMULATIONS OF ASPIRIN FOR INHALATION OTITOPIC INC. (US) 2017-06-15 WO disclosed
WO-2006082596-A2 NEEM OIL CONTRACEPTIVE FORMULATIONS SINGH KAMALINDER KAUR (IN) 2006-08-10 WO disclosed
US-20060135613-A1 Carboxamides derivatives BAYER HEALTHCARE AG (DE) 2006-06-22 US disclosed
CN-1232242-C Oral compositions against halitosis LG LIVING & HEALTH CARE LTD (KR) 2005-12-21 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 (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-20060135613-A1 Carboxamides derivatives BPHL, HRH2, HRH4 TDP1 4168/4885PDE4A 1018/4885LMNA 1869/4885

“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.