SCHEMBL4865168

SCHEMBL4865168

O=C(NCc1ccccc1)N1CCCCc2ccccc21

nearest known ligand 0.71

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 4/20 0.71
▸ LMNA P02545 5/20 0.61
▸ THRB P10828 2/20 0.59
▸ MAPT P10636 1/20 0.57
▸ POLB P06746 2/20 0.56
▸ RECQL P46063 1/20 0.56
▸ PRMT5 O14744 1/20 0.56
▸ WDR77 Q9BQA1 1/20 0.56
▸ AVPR2 P30518 2/20 0.55
▸ SMN1; SMN2 Q16637 1/20 0.54

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
SCHEMBL4869945 0.92 TP53 (0.63) TP53LMNATHRBMAPTPOLB
SCHEMBL4868734 0.92 TP53 (0.62) TP53LMNATHRBMAPTPOLB
SCHEMBL4862542 0.91 AVPR2 (0.63) TP53LMNATHRBMAPTPRMT5
SCHEMBL4869441 0.91 TP53 (0.61) TP53LMNATHRBMAPTPRMT5
SCHEMBL4863797 0.91 POLB (0.65) TP53LMNATHRBMAPTPOLB
SCHEMBL1867242 0.90 NPC1 (0.62) TP53LMNAMAPTPRMT5WDR77
SCHEMBL4868521 0.90 TP53 (0.63) TP53LMNATHRBMAPT
SCHEMBL4870647 0.89 TP53 (0.62) TP53LMNATHRBMAPTPOLB
SCHEMBL4867135 0.88 LMNA (0.60) TP53LMNATHRBMAPTPOLB
SCHEMBL4871802 0.88 THRB (0.76) TP53LMNATHRBMAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7368444-B2 N-carbamoyl nitrogen-containing fused ring compounds and drugs containing these compounds as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2008-05-06 — — US claimed
EP-1778677-A1 HETEROCYCLIC CONDENSED COMPOUNDS USEFUL AS ANTIDIURETIC AGENTS Ferring B.V. (NL) 2007-05-02 — — EP claimed
WO-2006018443-A1 HETEROCYCLIC CONDENSED COMPOUNDS USEFUL AS ANTIDIURETIC AGENTS FERRING B.V. (NL) 2006-02-23 — — WO claimed
US-20080194620-A1 Use of Benzodiazepine Receptor Ligands For Combating Signs of Ageing L'OREAL (FR) 2008-08-14 — — US disclosed
US-20080194620-A1 Use of Benzodiazepine Receptor Ligands For Combating Signs of Ageing L'OREAL (FR) 2008-08-14 — — US disclosed
US-7368444-B2 N-carbamoyl nitrogen-containing fused ring compounds and drugs containing these compounds as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2008-05-06 — — US disclosed
US-7368444-B2 N-carbamoyl nitrogen-containing fused ring compounds and drugs containing these compounds as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2008-05-06 — — US disclosed
US-7368444-B2 N-carbamoyl nitrogen-containing fused ring compounds and drugs containing these compounds as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2008-05-06 — — US disclosed
US-20050101600-A1 N-carbamoyl nitrogen-containing fused ring compounds and drugs containing these compounds as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2005-05-12 — — US disclosed
EP-1475368-A1 N-CARBAMOYL NITROGEN-CONTAINING FUSED RING COMPOUNDS AND DRUGS CONTAINING THESE COMPOUNDS AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2004-11-10 — — EP 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-20080194620-A1 Use of Benzodiazepine Receptor Ligands For Combating Signs of Ageing GABBR1, GABBR2, GABRA2 TP53 3564/4885LMNA 1188/4885THRB 490/4885
US-20050101600-A1 N-carbamoyl nitrogen-containing fused ring compounds and drugs containing these compounds as the active ingredient CNR1, CNR2, NPSR1 TP53 4170/4885LMNA 2162/4885THRB 1930/4885

“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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