SCHEMBL20411514

SCHEMBL20411514

CC(C)CCC[C@@H](C)C1CC[C@H]2C3CC=C4C[C@@H](OCCOCCOCCOCCOCCNC(=O)CBr)CCC4(C)[C@H]3CCC12C

nearest known ligand 0.68

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ POLA1 P09884 1/20 0.68
▸ CYP46A1 Q9Y6A2 2/20 0.63
▸ OSBP P22059 3/20 0.59
▸ USP2 O75604 2/20 0.59
▸ LMNA P02545 1/20 0.59
▸ ABCB1 P08183 1/20 0.59
▸ RORC P51449 1/20 0.59
▸ OSBP2 Q969R2 1/20 0.59
▸ GBA1 P04062 2/20 0.58
▸ UGCG Q16739 2/20 0.58
▸ GBA2 Q9HCG7 2/20 0.58
▸ NPC1L1 Q9UHC9 5/20 0.58
▸ NR1H3 Q13133 4/20 0.53
▸ GRIN1 Q05586 1/20 0.51
▸ GRIN2A Q12879 1/20 0.51

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
SCHEMBL18076222 1.00 POLA1 (0.68) POLA1CYP46A1OSBPUSP2LMNA
SCHEMBL18199503 1.00 POLA1 (0.68) POLA1CYP46A1OSBPUSP2LMNA
SCHEMBL18120312 1.00 POLA1 (0.68) POLA1CYP46A1OSBPUSP2LMNA
SCHEMBL18120320 0.94 POLA1 (0.69) POLA1CYP46A1OSBPUSP2LMNA
SCHEMBL318235 0.92 POLA1 (0.61) POLA1CYP46A1OSBPUSP2LMNA
SCHEMBL9949178 0.92 POLA1 (0.61) POLA1CYP46A1OSBPUSP2LMNA
SCHEMBL318236 0.92 POLA1 (0.61) POLA1CYP46A1OSBPUSP2LMNA
SCHEMBL9949176 0.92 POLA1 (0.61) POLA1CYP46A1OSBPUSP2LMNA
SCHEMBL3155812 0.92 POLA1 (0.61) POLA1CYP46A1OSBPUSP2LMNA
SCHEMBL12990241 0.92 POLA1 (0.61) POLA1CYP46A1OSBPUSP2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180207276-A1 MODIFIED THERAPEUTIC AGENTS AND COMPOSITIONS THEREOF THE CALIFORNIA INSTITUTE FOR BIOMEDICAL RESEARCH 2018-07-26 — — 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 (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-20180207276-A1 MODIFIED THERAPEUTIC AGENTS AND COMPOSITIONS THEREOF HDGF, ELANE, CD47 POLA1 1778/4885CYP46A1 1617/4885OSBP 3660/4885

“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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