SCHEMBL12639550

SCHEMBL12639550

C#CC(=O)N(c1cccc(C(F)(F)F)c1)C(C(=O)NC1CCCCC1)c1cccc(Cl)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 4/20 0.44
▸ LMNA P02545 4/20 0.44
▸ KDM4E B2RXH2 2/20 0.44
▸ EPHX2 P34913 1/20 0.43
▸ MDM2 Q00987 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ L3MBTL1 Q9Y468 3/20 0.40
▸ POLB P06746 2/20 0.40
▸ HTT P42858 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ MAPT P10636 2/20 0.40
▸ CNR1 P21554 2/20 0.40
▸ CNR2 P34972 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.39
▸ HTR1E P28566 1/20 0.39
▸ S1PR3 Q99500 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
SCHEMBL12639594 0.91 LMNA (0.45) GAALMNAKDM4EEPHX2MDM2
SCHEMBL12639506 0.91 LMNA (0.47) GAALMNAKDM4EEPHX2SMN1; SMN2
SCHEMBL12639503 0.90 KMT2A (0.45) KDM4EEPHX2KMT2AMEN1ALDH1A1
SCHEMBL12639556 0.90 POLB (0.42) GAALMNAKDM4EEPHX2MDM2
SCHEMBL12639554 0.89 EPHX2 (0.43) GAALMNAKDM4EEPHX2MDM2
SCHEMBL12639581 0.89 KMT2A (0.45) GAALMNAKDM4EEPHX2SMN1; SMN2
SCHEMBL12672265 0.89 EPHX2 (0.43) GAALMNAKDM4EEPHX2SMN1; SMN2
SCHEMBL13579148 0.89 EPHX2 (0.43) GAALMNAKDM4EEPHX2SMN1; SMN2
SCHEMBL12639608 0.89 EPHX2 (0.46) GAALMNAKDM4EEPHX2MDM2
SCHEMBL12639558 0.88 KMT2A (0.44) GAALMNAKDM4EEPHX2SMN1; 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8519188-B2 Compounds which can be used for the treatment of cancers Marc-Henry Pitty (FR) 2013-08-27 — — US disclosed
US-8519188-B2 Compounds which can be used for the treatment of cancers Marc-Henry Pitty (FR) 2013-08-27 — — US disclosed
US-20110104162-A1 Compounds which can be used for the Treatment of Cancers CYTOMICS SYSTEMS (FR) 2011-05-05 — — US disclosed
US-20110104162-A1 Compounds which can be used for the Treatment of Cancers CYTOMICS SYSTEMS (FR) 2011-05-05 — — US disclosed
WO-2009150248-A1 COMPOUNDS WHICH CAN BE USED FOR THE TREATMENT OF CANCERS CYTOMICS SYSTEMS (FR) 2009-12-17 — — 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 (1 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-20110104162-A1 Compounds which can be used for the Treatment of Cancers VHL, CYP11B2, SLC10A1 GAA 482/4885LMNA 2955/4885KDM4E 4220/4885

“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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