SCHEMBL29951354

SCHEMBL29951354

Nc1nc(Cl)c(C=O)c(=O)[nH]1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PNP P00491 2/20 0.41
▸ XDH P47989 1/20 0.39
▸ TYMS P04818 4/20 0.38
▸ LMNA P02545 1/20 0.38
▸ MAPT P10636 2/20 0.37
▸ CDK1 P06493 1/20 0.37
▸ CDK4 P11802 1/20 0.37
▸ CDK2 P24941 1/20 0.37
▸ MITF O75030 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ THRB P10828 1/20 0.36
▸ ALOX15 P16050 1/20 0.36
▸ HBB P68871 1/20 0.36
▸ HIF1A Q16665 1/20 0.36
▸ QTRT1 Q9BXR0 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ RECQL P46063 1/20 0.35
▸ DYRK1A Q13627 1/20 0.34

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
SCHEMBL29954149 0.79 CDK1 (0.48) PNPLMNAMAPTCDK1CDK4
SCHEMBL13022826 0.74 PNP (0.46) PNPXDHTYMSLMNAMAPT
SCHEMBL29954039 0.72 PNP (0.32) PNPXDHTYMSLMNA
SCHEMBL192661 0.71 LMNA (0.55) LMNAMAPTNPSR1RECQL
SCHEMBL4572376 0.68 CDK1 (0.66) PNPMAPTCDK1CDK4CDK2
SCHEMBL29952359 0.67 PNP (0.34) PNPMAPTCDK1CDK4CDK2
SCHEMBL6441238 0.67 XDH (0.53) PNPXDHLMNAMAPTCDK1
SCHEMBL6364307 0.66 LMNA (0.50) LMNAMAPTNPSR1RECQL
SCHEMBL727348 0.65 TYMS (0.44) PNPXDHTYMS
SCHEMBL29950870 0.64 LMNA (0.41) LMNAMAPTALOX15NPSR1RECQL

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-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 — — US disclosed
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