SCHEMBL12966982

SCHEMBL12966982

CCN(CC)CCCNC(=O)c1ccccc1Nc1cccc(/C=C/c2ccncc2)c1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ATG4B Q9Y4P1 2/20 0.43
▸ RAD52 P43351 1/20 0.43
▸ APP P05067 5/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ SIRT1 Q96EB6 2/20 0.42
▸ SIRT2 Q8IXJ6 1/20 0.42
▸ KIT P10721 1/20 0.41
▸ BRAF P15056 1/20 0.41
▸ ALDH1A1 P00352 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ NR1H4 Q96RI1 1/20 0.40
▸ PTGS2 P35354 1/20 0.39
▸ MAPK1 P28482 1/20 0.39

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
SCHEMBL1499548 0.86 IGF1R (0.45) KMT2ABRAFALDH1A1MAPK1
SCHEMBL1499549 0.86 IGF1R (0.45) KMT2ABRAFALDH1A1MAPK1
SCHEMBL1499432 0.85 HDAC6 (0.41) RAD52KMT2AALDH1A1KDM4EMAPK1
SCHEMBL1499435 0.85 HDAC6 (0.41) RAD52KMT2AALDH1A1KDM4EMAPK1
SCHEMBL12964827 0.81 MT-CO2 (0.55) RAD52APPKMT2AALDH1A1KDM4E
SCHEMBL1499494 0.80 PTGS2 (0.56) ATG4BRAD52APPKMT2AKIT
SCHEMBL1499345 0.80 HDAC6 (0.45) RAD52KMT2ABRAFALDH1A1MAPK1
SCHEMBL1499348 0.80 HDAC6 (0.45) RAD52KMT2ABRAFALDH1A1MAPK1
SCHEMBL12966945 0.79 BCHE (0.47) APPKMT2A
SCHEMBL1499341 0.76 KMT2A (0.45) ATG4BRAD52KMT2AALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10538485-B2 Compounds for use as therapeutic agents affecting P53 expression and/or activity ABIVAX (FR) 2020-01-21 — — US disclosed
US-20180127353-A1 COMPOUNDS FOR USE AS THERAPEUTIC AGENTS AFFECTING P53 EXPRESSION AND/OR ACTIVITY ABIVAX (FR) 2018-05-10 — — US disclosed
US-20180127353-A1 COMPOUNDS FOR USE AS THERAPEUTIC AGENTS AFFECTING P53 EXPRESSION AND/OR ACTIVITY ABIVAX (FR) 2018-05-10 — — US disclosed
US-9890112-B2 Compounds for use as therapeutic agents affecting p53 expression and/or activity ABIVAX (FR) 2018-02-13 — — US disclosed
US-9890112-B2 Compounds for use as therapeutic agents affecting p53 expression and/or activity ABIVAX (FR) 2018-02-13 — — US disclosed
US-20140206690-A1 COMPOUNDS FOR USE AS THERAPEUTIC AGENTS AFFECTING P53 EXPRESSION AND/OR ACTIVITY SOCIETE SPLICOS (FR) 2014-07-24 — — US disclosed
US-20140206690-A1 COMPOUNDS FOR USE AS THERAPEUTIC AGENTS AFFECTING P53 EXPRESSION AND/OR ACTIVITY SOCIETE SPLICOS (FR) 2014-07-24 — — US disclosed
WO-2012131656-A2 COMPOUNDS FOR USE AS THERAPEUTIC AGENTS AFFECTING P53 EXPRESSION AND/OR ACTIVITY SOCIÉTÉ SPLICOS (FR) 2012-10-04 — — 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 (3 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-20180127353-A1 COMPOUNDS FOR USE AS THERAPEUTIC AGENTS AFFECTING P53 EXPRESSION AND/OR ACTIVITY TP53, TP53BP1, BCOR ATG4B 3969/4885RAD52 1520/4885APP 3437/4885
US-10538485-B2 Compounds for use as therapeutic agents affecting P53 expression and/or activity TP53, TP53BP1, BCOR ATG4B 3969/4885RAD52 1520/4885APP 3437/4885
US-20140206690-A1 COMPOUNDS FOR USE AS THERAPEUTIC AGENTS AFFECTING P53 EXPRESSION AND/OR ACTIVITY TP53, CBR3, TP53BP1 ATG4B 3715/4885RAD52 2301/4885APP 2435/4885

“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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