SCHEMBL12967133

SCHEMBL12967133

CCN(CC)CCCNC(=O)c1ccccc1Nc1cccc(OC(F)(F)F)c1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MCHR1 Q99705 5/20 0.57
▸ APP P05067 6/20 0.46
▸ KMT2A Q03164 1/20 0.45
▸ HTT P42858 1/20 0.45
▸ GPR52 Q9Y2T5 1/20 0.45
▸ TAS2R14 Q9NYV8 1/20 0.44
▸ HDAC3 O15379 1/20 0.43
▸ HDAC1 Q13547 1/20 0.43
▸ RAD52 P43351 1/20 0.42
▸ RXFP1 Q9HBX9 1/20 0.42

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
SCHEMBL12766869 0.89 MCHR1 (0.55) MCHR1APPKMT2AHTTHDAC3
SCHEMBL12964611 0.84 MCHR1 (0.51) MCHR1KMT2AHTTHDAC3HDAC1
SCHEMBL1499645 0.83 MCHR1 (0.62) MCHR1KMT2A
SCHEMBL12964827 0.82 MT-CO2 (0.55) APPKMT2AHTTRAD52
SCHEMBL12767204 0.79 KMT2A (0.65) MCHR1APPKMT2ARXFP1
SCHEMBL12760659 0.78 MCHR1 (0.48) MCHR1KMT2AHTTHDAC3HDAC1
SCHEMBL12760660 0.78 MCHR1 (0.48) MCHR1KMT2AHTTHDAC3HDAC1
SCHEMBL12964680 0.77 MT-CO2 (0.58) APPKMT2AHTTRAD52
SCHEMBL1499494 0.76 PTGS2 (0.56) APPKMT2ARAD52
SCHEMBL12966982 0.76 ATG4B (0.43) APPKMT2ARAD52

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 MCHR1 2785/4885APP 3437/4885KMT2A 3766/4885
US-10538485-B2 Compounds for use as therapeutic agents affecting P53 expression and/or activity TP53, TP53BP1, BCOR MCHR1 2785/4885APP 3437/4885KMT2A 3766/4885
US-20140206690-A1 COMPOUNDS FOR USE AS THERAPEUTIC AGENTS AFFECTING P53 EXPRESSION AND/OR ACTIVITY TP53, CBR3, TP53BP1 MCHR1 1928/4885APP 2435/4885KMT2A 3694/4885

“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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