SCHEMBL27138735

SCHEMBL27138735

CCCc1n[nH]c(CC)c1O

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ HCAR2 Q8TDS4 6/20 0.36
▸ HTT P42858 1/20 0.36
▸ ALPL P05186 1/20 0.33
▸ HCAR3 P49019 1/20 0.33
▸ GLA P06280 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ KCNH2 Q12809 1/20 0.31
▸ PDE5A O76074 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
SCHEMBL27140068 0.89 HTT (0.37) HCAR2HTTALPLHCAR3GLA
SCHEMBL27143064 0.88 HCAR2 (0.40) HCAR2HTTHCAR3GAA
SCHEMBL27152639 0.85 HCAR2 (0.39) HCAR2HCAR3KCNH2
SCHEMBL27144214 0.84 HCAR2 (0.44) HCAR2HTTALPLHCAR3GAA
SCHEMBL27139062 0.83 HCAR2 (0.34) HCAR2HTTALPLGLAKCNH2
SCHEMBL27154336 0.81 CCNC (0.33) HCAR2HTTALPL
SCHEMBL27143712 0.80 HCAR2 (0.40) HCAR2HTTHCAR3GAA
SCHEMBL27141935 0.78 HCAR2 (0.45) HCAR2HTTHCAR3GAA
SCHEMBL27141710 0.77 HTT (0.37) HCAR2HTTALPLHCAR3GLA
SCHEMBL27138813 0.76 HCAR2 (0.44) HCAR2HCAR3GAA

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
US-20240208911-A1 POLYMERIZATION INHIBITORS BASF SE (DE) 2024-06-27 — — US disclosed
EP-4326783-A1 POLYMERIZATION INHIBITORS BASF SE (DE) 2024-02-28 — — EP disclosed
CN-117222675-A polymerization inhibitor 巴斯夫欧洲公司 2023-12-12 — — CN disclosed
WO-2022223336-A1 POLYMERIZATION INHIBITORS BASF SE (DE) 2022-10-27 — — 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-20240208911-A1 POLYMERIZATION INHIBITORS CDK5, CABLES1, DPYD HCAR2 2930/4885HTT 1252/4885ALPL 4430/4885

“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.

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