SCHEMBL4884646

SCHEMBL4884646

NCCCCC(NC(=O)Nc1cccc2ccccc12)C(=O)Nc1ccc(CNC(=O)C2CCCCC2)cc1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ NTMT1 Q9BV86 1/20 0.51
▸ PLG P00747 1/20 0.48
▸ CPB2 Q96IY4 2/20 0.45
▸ KLKB1 P03952 1/20 0.44
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ EPHX1 P07099 1/20 0.42
▸ KDM4E B2RXH2 2/20 0.42
▸ GSK3B P49841 1/20 0.42
▸ GRIN1 Q05586 1/20 0.42
▸ GRIN2A Q12879 1/20 0.42
▸ CTSH P09668 1/20 0.41
▸ CTSK P43235 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ TACR1 P25103 1/20 0.41
▸ HDAC1 Q13547 1/20 0.41
▸ CTSB P07858 1/20 0.41
▸ ITGB1 P05556 1/20 0.41
▸ ITGA4 P13612 1/20 0.41

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
SCHEMBL4884654 0.89 NTMT1 (0.50) NTMT1PLGCPB2MEN1KMT2A
SCHEMBL4887070 0.88 PLG (0.55) PLGCPB2KLKB1GRIN1GRIN2A
SCHEMBL4885602 0.88 PLG (0.54) PLGCPB2KLKB1GRIN1GRIN2A
SCHEMBL4886959 0.88 GRIN1 (0.53) NTMT1PLGKLKB1GRIN1GRIN2A
SCHEMBL4879315 0.81 CPB2 (0.50) PLGCPB2KLKB1GRIN1GRIN2A
SCHEMBL4884651 0.80 NTMT1 (0.46) NTMT1PLGMEN1KMT2AKDM4E
SCHEMBL4888144 0.78 UTS2R (0.47) —
SCHEMBL4885609 0.77 CPB2 (0.51) PLGCPB2KLKB1EPHX1TACR1
SCHEMBL4886971 0.77 CHRNB2 (0.52) NTMT1PLGGRIN1GRIN2ATACR1
SCHEMBL4887082 0.76 PLG (0.50) PLGCPB2KLKB1MEN1KMT2A

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-20080171783-A1 COMPOSITIONS AND METHODS FOR TREATING HYPERPROLIFERATIVE DISEASE MIGENIX INC. (CA) 2008-07-17 — — US disclosed
US-20070021434-A1 NON-NUCLEOSIDE ANTI-HEPACIVIRUS AGENTS AND USES THEREOF MIGENIX INC. (CA) 2007-01-25 — — 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-20070021434-A1 NON-NUCLEOSIDE ANTI-HEPACIVIRUS AGENTS AND USES THEREOF HAVCR2, ADAR, NSUN2 NTMT1 506/4885PLG 3666/4885CPB2 1198/4885
US-20080171783-A1 COMPOSITIONS AND METHODS FOR TREATING HYPERPROLIFERATIVE DISEASE POLQ, POLI, POLH NTMT1 1494/4885PLG 551/4885CPB2 1322/4885

“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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