SCHEMBL1767382

SCHEMBL1767382

O=C(NCc1ccc(F)cc1)c1ccnc(N2CCN(Cc3ccc(F)cc3F)C2=O)c1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SCD O00767 5/20 0.47
▸ PPARG P37231 3/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ TP53 P04637 2/20 0.44
▸ HDAC1 Q13547 1/20 0.43
▸ LMNA P02545 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ TSHR P16473 1/20 0.40
▸ KLKB1 P03952 1/20 0.40
▸ KLK1 P06870 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ KDM4C Q9H3R0 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
SCHEMBL1767626 0.91 SCD (0.56) SCDL3MBTL1TP53HDAC1LMNA
SCHEMBL1767520 0.88 SCD (0.50) SCDL3MBTL1TP53HDAC1LMNA
SCHEMBL1767388 0.87 L3MBTL1 (0.54) SCDL3MBTL1TP53HDAC1SMN1; SMN2
SCHEMBL1767544 0.87 L3MBTL1 (0.54) SCDL3MBTL1TP53HDAC1SMN1; SMN2
SCHEMBL1568693 0.87 SCD (0.62) SCDL3MBTL1TP53HDAC1LMNA
SCHEMBL17263333 0.87 SCD (0.53) SCDL3MBTL1TP53HDAC1LMNA
SCHEMBL1767389 0.86 SCD (0.50) SCDL3MBTL1TP53HDAC1SMN1; SMN2
SCHEMBL1767455 0.85 HDAC1 (0.52) SCDL3MBTL1TP53HDAC1LMNA
SCHEMBL1767557 0.85 SCD (0.58) SCDL3MBTL1TP53HDAC1LMNA
SCHEMBL1767494 0.83 SCD (0.47) SCDL3MBTL1TP53LMNASMN1; 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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160289191-A1 ORGANIC COMPOUNDS XENON PHARMACEUTICALS INC. (CA) 2016-10-06 — — US claimed
US-20110105530-A1 ORGANIC COMPOUNDS XENON PHARMACEUTICALS INC. (CA) 2011-05-05 — — US claimed
US-20160289191-A1 ORGANIC COMPOUNDS XENON PHARMACEUTICALS INC. (CA) 2016-10-06 — — US disclosed
US-20160289191-A1 ORGANIC COMPOUNDS XENON PHARMACEUTICALS INC. (CA) 2016-10-06 — — US disclosed
US-9187426-B2 Organic compounds NOVARTIS AG (CH) 2015-11-17 — — US disclosed
US-9187426-B2 Organic compounds NOVARTIS AG (CH) 2015-11-17 — — US disclosed
US-20110105530-A1 ORGANIC COMPOUNDS XENON PHARMACEUTICALS INC. (CA) 2011-05-05 — — US disclosed
US-20110105530-A1 ORGANIC COMPOUNDS XENON PHARMACEUTICALS INC. (CA) 2011-05-05 — — US disclosed
WO-2009156484-A2 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-12-30 — — 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 (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-20110105530-A1 ORGANIC COMPOUNDS SCD, SCD5, FADS2 SCD 1/4885PPARG 28/4885L3MBTL1 4314/4885
US-20160289191-A1 ORGANIC COMPOUNDS SCD, SCD5, FADS2 SCD 1/4885PPARG 28/4885L3MBTL1 4314/4885

“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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