SCHEMBL12639558

SCHEMBL12639558

C#CC(=O)N(c1cccc(C(F)(F)F)c1)C(C(=O)NC1CCCCC1)c1ccc(C(C)C)cc1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 5/20 0.44
▸ HTT P42858 3/20 0.44
▸ LMNA P02545 2/20 0.44
▸ EPHX2 P34913 1/20 0.44
▸ GAA P10253 3/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ CCR2 P41597 1/20 0.42
▸ NPSR1 Q6W5P4 2/20 0.42
▸ TSHR P16473 1/20 0.41
▸ MEN1 O00255 3/20 0.41
▸ ALDH1A1 P00352 2/20 0.40
▸ GLA P06280 1/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.40
▸ MAPT P10636 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ POLB P06746 1/20 0.40

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
SCHEMBL12639608 0.94 EPHX2 (0.46) KMT2AHTTLMNAEPHX2GAA
SCHEMBL12639536 0.93 KMT2A (0.46) KMT2AHTTLMNAEPHX2GAA
SCHEMBL12639533 0.92 POLB (0.46) KMT2AHTTLMNAEPHX2GAA
SCHEMBL12639539 0.92 KMT2A (0.48) KMT2AHTTLMNAEPHX2GAA
SCHEMBL12639509 0.92 KMT2A (0.45) KMT2AHTTLMNAEPHX2NPSR1
SCHEMBL12639506 0.92 LMNA (0.47) KMT2ALMNAEPHX2GAASMN1; SMN2
SCHEMBL12639681 0.91 KMT2A (0.46) KMT2AHTTLMNAEPHX2TSHR
SCHEMBL12639545 0.90 KMT2A (0.50) KMT2AHTTNPSR1MEN1ALDH1A1
SCHEMBL12639557 0.90 CCR2 (0.42) KMT2AHTTLMNAEPHX2GAA
SCHEMBL12639594 0.90 LMNA (0.45) KMT2AHTTLMNAEPHX2GAA

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 KMT2A 3789/4885HTT 1971/4885LMNA 2955/4885

“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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