SCHEMBL17263334

SCHEMBL17263334

O=C(NCc1cnc(Cl)s1)c1ccnc(N2CCN(Cc3ccc(OCF)cc3)C2=O)c1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SCD O00767 10/20 0.44
▸ SLC8A1 P32418 2/20 0.38
▸ HDAC1 Q13547 4/20 0.38
▸ THRB P10828 2/20 0.36
▸ MAPT P10636 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ KDM1A O60341 1/20 0.35

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
SCHEMBL1767489 0.91 SCD (0.43) SCDSLC8A1HDAC1
SCHEMBL17263335 0.90 SCD (0.42) SCDHDAC1THRBMAPTKDM1A
SCHEMBL1767515 0.90 SCD (0.52) SCDHDAC1MAPT
SCHEMBL1767464 0.88 HDAC1 (0.49) SCDHDAC1KDM1A
SCHEMBL1767533 0.88 SCD (0.45) SCDHDAC1MAPT
SCHEMBL17263326 0.85 SCD (0.45) SCDHDAC1THRBMAPT
SCHEMBL16160216 0.81 HDAC1 (0.48) SCDHDAC1MAPTKDM1A
SCHEMBL1767462 0.81 SCD (0.41) SCDHDAC1
SCHEMBL1767688 0.80 SCD (0.50) SCDHDAC1MAPTL3MBTL1
SCHEMBL17263331 0.80 SCD (0.44) SCDHDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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-20160289191-A1 ORGANIC COMPOUNDS SCD, SCD5, FADS2 SCD 1/4885SLC8A1 4335/4885HDAC1 136/4885

“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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