SCHEMBL23340490

SCHEMBL23340490

CN1COCN(C)c2nc(Cl)n(Cc3nnc(-c4ccc(F)cc4)o3)c2C1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 4/20 0.43
▸ SMN1; SMN2 Q16637 4/20 0.43
▸ LMNA P02545 3/20 0.43
▸ HTT P42858 3/20 0.43
▸ MAPT P10636 3/20 0.43
▸ PTGS2 P35354 2/20 0.42
▸ RAB9A P51151 3/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ POLB P06746 2/20 0.40
▸ USP2 O75604 1/20 0.40
▸ NPC1 O15118 3/20 0.39
▸ PKM P14618 1/20 0.38
▸ TP53 P04637 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ NUDT5 Q9UKK9 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ HDAC8 Q9BY41 1/20 0.35
▸ BRD4 O60885 1/20 0.35
▸ EGFR P00533 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
SCHEMBL23340547 0.92 RAB9A (0.50) TSHRSMN1; SMN2LMNAHTTMAPT
SCHEMBL23340492 0.90 ALDH1A1 (0.43) TSHRSMN1; SMN2LMNAHTTMAPT
SCHEMBL23340632 0.90 SMN1; SMN2 (0.41) TSHRSMN1; SMN2LMNAHTTMAPT
SCHEMBL23340505 0.89 PTK2 (0.44) TSHRSMN1; SMN2LMNAHTTMAPT
SCHEMBL23340548 0.89 RAB9A (0.40) TSHRSMN1; SMN2LMNAHTTMAPT
SCHEMBL23340635 0.89 PTK2 (0.43) TSHRSMN1; SMN2LMNAHTTMAPT
SCHEMBL23340549 0.87 RAB9A (0.38) TSHRSMN1; SMN2LMNAHTTMAPT
SCHEMBL23340324 0.86 RAB9A (0.41) TSHRSMN1; SMN2LMNAHTTMAPT
SCHEMBL23340633 0.84 MAPK1 (0.44) TSHRSMN1; SMN2LMNAMAPTRAB9A
SCHEMBL23340699 0.84 NLRP3 (0.41) TSHRHTTPTGS2RAB9AALDH1A1

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-20210128566-A1 NOVEL FUNCTIONALIZED PURINE-2,6-DIONES AND THEIR USE IN MEDICINE THOMAS HELLEDAYS STIFTELSE FÖR MEDICINSK FORSKNING (SE) 2021-05-06 — — 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-20210128566-A1 NOVEL FUNCTIONALIZED PURINE-2,6-DIONES AND THEIR USE IN MEDICINE ADORA2A, HPRT1, PNP TSHR 1719/4885SMN1; SMN2 989/4885LMNA 2659/4885

“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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