SCHEMBL20182588

SCHEMBL20182588

Cn1c(=O)n(CC2CCC(F)(F)CC2)c(=O)c2c1ncn2CC1CCCCC1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.47
▸ RXFP1 Q9HBX9 1/20 0.44
▸ TRPA1 O75762 3/20 0.42
▸ ADORA2B P29275 4/20 0.40
▸ POLB P06746 1/20 0.40
▸ HIF1A Q16665 1/20 0.40
▸ LMNA P02545 2/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ MAOA P21397 1/20 0.39
▸ MAOB P27338 1/20 0.39
▸ CYP11B2 P19099 1/20 0.39
▸ MAPT P10636 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
SCHEMBL18819581 0.87 KMT2A (0.50) KMT2ARXFP1TRPA1ADORA2BPOLB
SCHEMBL18256096 0.85 ADORA2B (0.53) RXFP1ADORA2BPOLBLMNASMN1; SMN2
SCHEMBL18819083 0.85 KMT2A (0.48) KMT2ARXFP1TRPA1ADORA2BPOLB
SCHEMBL19607674 0.84 KMT2A (0.47) KMT2ARXFP1TRPA1ADORA2BPOLB
SCHEMBL17682250 0.83 KMT2A (0.52) KMT2ARXFP1TRPA1ADORA2BPOLB
SCHEMBL17682284 0.83 KMT2A (0.52) KMT2ARXFP1TRPA1ADORA2BPOLB
SCHEMBL17682285 0.83 KMT2A (0.52) KMT2ARXFP1TRPA1ADORA2BPOLB
SCHEMBL24611663 0.83 KMT2A (0.44) KMT2ARXFP1TRPA1ADORA2BPOLB
SCHEMBL20205938 0.82 KMT2A (0.48) KMT2ARXFP1TRPA1ADORA2BPOLB
SCHEMBL18819573 0.82 KMT2A (0.47) KMT2ARXFP1TRPA1ADORA2BPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10278973-B2 Hydroxyl purine compounds and use thereof Guangdong Raynovent Biotech Co., Ltd. (CN) 2019-05-07 — — US disclosed
US-20180140607-A1 HYDROXYL PURINE COMPOUNDS AND USE THEREOF Guangdong Raynovent Biotech Co., Ltd. (CN) 2018-05-24 — — 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 (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-20180140607-A1 HYDROXYL PURINE COMPOUNDS AND USE THEREOF PNP, PDE7A, PDE2A KMT2A 3576/4885RXFP1 1174/4885TRPA1 2926/4885
US-10278973-B2 Hydroxyl purine compounds and use thereof PNP, PDE7A, PDE2A KMT2A 3576/4885RXFP1 1174/4885TRPA1 2926/4885

“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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