SCHEMBL18256622

SCHEMBL18256622

CC(C)Cn1cnc2c1c(=O)n(CC1(C)COC1)c(=O)n2C

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.49
▸ LMNA P02545 2/20 0.49
▸ PDE1A P54750 1/20 0.45
▸ PDE1B Q01064 1/20 0.45
▸ PDE1C Q14123 1/20 0.45
▸ POLB P06746 2/20 0.45
▸ KMT2A Q03164 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ TRPA1 O75762 2/20 0.42
▸ HIF1A Q16665 1/20 0.42

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
SCHEMBL20205776 0.87 LMNA (0.43) SMN1; SMN2LMNAPOLBKMT2ATRPA1
SCHEMBL18256643 0.83 ADORA2B (0.56) SMN1; SMN2LMNAPOLB
SCHEMBL18256710 0.83 KMT2A (0.51) LMNAPOLBKMT2ATRPA1HIF1A
SCHEMBL18256623 0.83 KMT2A (0.43) LMNAPOLBKMT2ATRPA1HIF1A
SCHEMBL18256066 0.80 KMT2A (0.60) SMN1; SMN2LMNAPOLBKMT2AALDH1A1
SCHEMBL20205786 0.79 KMT2A (0.46) LMNAPOLBKMT2ATRPA1HIF1A
SCHEMBL18256624 0.78 CNOT7 (0.39) SMN1; SMN2LMNAALDH1A1NPSR1
SCHEMBL20011104 0.77 LMNA (0.62) SMN1; SMN2LMNAPDE1APDE1BPDE1C
Isbufylline SCHEMBL678978 0.76 LMNA (0.78) SMN1; SMN2LMNAPOLBKMT2A
SCHEMBL19601332 0.74 LMNA (0.48) SMN1; SMN2LMNAPDE1APDE1BPDE1C

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-10618898-B2 Hydroxyl purine compounds and use thereof Guangdong Raynovent Biotech Co., Ltd. (CN) 2020-04-14 — — US disclosed
US-20180148451-A1 HYDROXYL PURINE COMPOUNDS AND USE THEREOF Guangdong Raynovent Biotech Co., Ltd. (CN) 2018-05-31 — — US disclosed
US-20180148451-A1 HYDROXYL PURINE COMPOUNDS AND USE THEREOF Guangdong Raynovent Biotech Co., Ltd. (CN) 2018-05-31 — — US disclosed
WO-2016184313-A1 HYDROXYL PURINE COMPOUNDS AND USE THEREOF 南京明德新药研发股份有限公司 2016-11-24 — — 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 (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-20180148451-A1 HYDROXYL PURINE COMPOUNDS AND USE THEREOF PNP, PDE7A, PDE2A SMN1; SMN2 1801/4885LMNA 2283/4885PDE1A 124/4885
US-10618898-B2 Hydroxyl purine compounds and use thereof PNP, PDE7A, PDE2A SMN1; SMN2 1801/4885LMNA 2283/4885PDE1A 124/4885

“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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