SCHEMBL29877863

SCHEMBL29877863

O=C(O)c1cc(C2CC2)c(Cl)cn1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ASPH Q12797 4/20 0.44
▸ KDM8 Q8N371 3/20 0.44
▸ KMO O15229 10/20 0.41
▸ KDM4E B2RXH2 3/20 0.41
▸ GLA P06280 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ HIF1A Q16665 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ HCAR2 Q8TDS4 2/20 0.41
▸ RIOX2 Q8IUF8 1/20 0.38
▸ P4HA1 P13674 1/20 0.35
▸ MIF P14174 1/20 0.35
▸ P4HTM Q9NXG6 1/20 0.35
▸ PDCD1 Q15116 1/20 0.35
▸ CD274 Q9NZQ7 1/20 0.35
▸ KDM5A P29375 1/20 0.35
▸ KDM4C Q9H3R0 1/20 0.35

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
SCHEMBL15776120 0.86 ASPH (0.44) ASPHKDM8KMOKDM4EGLA
SCHEMBL29878040 0.81 MAPK1 (0.41) KDM4E
SCHEMBL21616744 0.77 ASPH (0.45) ASPHKDM8KMOKDM4EGLA
SCHEMBL29712296 0.75 KMO (0.52) ASPHKDM8KMOKDM4ESMN1; SMN2
SCHEMBL3408592 0.75 KMO (0.52) ASPHKDM8KMOKDM4ESMN1; SMN2
SCHEMBL20772273 0.75 CYP17A1 (0.40) KMT2A
SCHEMBL23612070 0.74 CNR2 (0.38) ASPHKDM8KMOKDM4EGLA
SCHEMBL29989008 0.74 CNR2 (0.38) ASPHKDM8KMOKDM4EGLA
SCHEMBL30703822 0.73 ASPH (0.45) ASPHKDM8KMOKDM4EGLA
SCHEMBL24660110 0.73 ASPH (0.40) ASPHKDM8KMOKDM4EGLA

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-20240317752-A1 6-SUBSTITUTED-9H-PURINE DERIVATIVES AND RELATED USES BLACK DIAMOND THERAPEUTICS, INC. (US) 2024-09-26 — — US disclosed
WO-2022178256-A1 6-SUBSTITUTED-9H-PURINE DERIVATIVES AND RELATED USES BLACK DIAMOND THERAPEUTICS, INC. (US) 2022-08-25 — — 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-20240317752-A1 6-SUBSTITUTED-9H-PURINE DERIVATIVES AND RELATED USES TYMP, DPYD, PNP ASPH 3059/4885KDM8 3935/4885KMO 2930/4885

“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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