SCHEMBL17682144

SCHEMBL17682144

CCC(O)(CC)CCCCn1c(=O)c2c(ncn2CC(O)CN(C)CCO)n(C)c1=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 6/20 0.53
▸ SMN1; SMN2 Q16637 3/20 0.47
▸ POLB P06746 2/20 0.47
▸ RXFP1 Q9HBX9 4/20 0.47
▸ PDE4A P27815 4/20 0.45
▸ CYP1A2 P05177 2/20 0.45
▸ NFKB1 P19838 2/20 0.45
▸ ACHE P22303 2/20 0.45
▸ PMP22 Q01453 2/20 0.45
▸ ESR1 P03372 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ BLM P54132 1/20 0.45
▸ PDE4B Q07343 3/20 0.39
▸ PDE4C Q08493 3/20 0.39
▸ PDE4D Q08499 3/20 0.39
▸ ADORA2B P29275 2/20 0.39
▸ TNF P01375 2/20 0.39
▸ USP2 O75604 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ GAA P10253 1/20 0.39

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
SCHEMBL19601307 0.94 LMNA (0.48) LMNASMN1; SMN2POLBRXFP1PDE4A
SCHEMBL17682127 0.87 LMNA (0.62) LMNASMN1; SMN2POLBRXFP1PDE4A
SCHEMBL28415031 0.85 LMNA (0.60) LMNASMN1; SMN2POLBRXFP1PDE4A
SCHEMBL28870869 0.83 TNF (0.61) LMNASMN1; SMN2POLBRXFP1PDE4A
SCHEMBL17682120 0.82 ADORA2B (0.58) LMNASMN1; SMN2RXFP1PDE4ACYP1A2
SCHEMBL17682218 0.81 LMNA (0.54) LMNASMN1; SMN2POLBRXFP1PDE4A
Xanthinol SCHEMBL121656 0.81 LMNA (0.73) LMNASMN1; SMN2POLBRXFP1ADORA2B
SCHEMBL17682157 0.80 PDE4A (0.57) LMNASMN1; SMN2POLBRXFP1PDE4A
SCHEMBL10346500 0.78 LMNA (0.65) LMNASMN1; SMN2POLBRXFP1PDE4A
SCHEMBL18819566 0.77 LMNA (0.63) LMNASMN1; SMN2POLBRXFP1ADORA2B

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
US-RE49128-E1 Hydroxyl purine compounds and applications thereof Guangdong Raynovent Biotech Co., Ltd. (CN) 2022-07-12 — — US disclosed
US-20170326149-A1 HYDROXYL PURINE COMPOUNDS AND APPLICATIONS THEREOF GUANGDONG ZHONGSHENG PHARMACEUTICAL CO., LTD (CN) 2017-11-16 — — US disclosed
US-20170326149-A1 HYDROXYL PURINE COMPOUNDS AND APPLICATIONS THEREOF GUANGDONG ZHONGSHENG PHARMACEUTICAL CO., LTD (CN) 2017-11-16 — — US disclosed
EP-3205652-A1 HYDROXYL PURINE COMPOUNDS AND APPLICATIONS THEREOF Medshine Discovery Inc. (CN) 2017-08-16 — — EP disclosed
WO-2017071606-A1 MEDICAL USE OF HYDROXYL PURINE COMPOUND 南京明德新药研发股份有限公司 2017-05-04 — — WO disclosed
WO-2016054971-A1 HYDROXYL PURINE COMPOUNDS AND APPLICATIONS THEREOF 南京明德新药研发股份有限公司 2016-04-14 — — 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-20170326149-A1 HYDROXYL PURINE COMPOUNDS AND APPLICATIONS THEREOF PNP, PDE2A, PDE7A LMNA 2616/4885SMN1; SMN2 1807/4885POLB 343/4885

“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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