SCHEMBL14667495

SCHEMBL14667495

Nc1ccccc1NC(=O)CSCCCOC1CCCCC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC3 O15379 13/20 0.47
▸ HDAC1 Q13547 12/20 0.47
▸ HDAC2 Q92769 11/20 0.47
▸ HDAC10 Q969S8 7/20 0.44
▸ HDAC6 Q9UBN7 7/20 0.44
▸ HDAC4 P56524 6/20 0.44
▸ HDAC7 Q8WUI4 6/20 0.44
▸ HDAC11 Q96DB2 6/20 0.44
▸ HDAC8 Q9BY41 6/20 0.44
▸ HDAC9 Q9UKV0 6/20 0.44
▸ HDAC5 Q9UQL6 6/20 0.44
▸ NCOR2 Q9Y618 6/20 0.44
▸ HPGD P15428 5/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ ALDH1A1 P00352 2/20 0.39
▸ MAPT P10636 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ USP2 O75604 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ LMNA P02545 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
SCHEMBL14667492 0.89 ALDH1A1 (0.43) HDAC3HDAC1HDAC2HDAC10HDAC6
SCHEMBL14667535 0.84 LNPEP (0.37) HDAC3HDAC1HDAC2HPGDALDH1A1
SCHEMBL14667513 0.83 ALDH1A1 (0.45) HPGDL3MBTL1ALDH1A1MAPTLMNA
SCHEMBL14667464 0.82 HPGD (0.51) HPGDL3MBTL1ALDH1A1MAPTLMNA
SCHEMBL14667471 0.81 HDAC3 (0.44) HDAC3HDAC1HDAC2HDAC10HDAC6
SCHEMBL14671096 0.80 HDAC3 (0.51) HDAC3HDAC1HDAC2HDAC10HDAC6
SCHEMBL14667392 0.80 HDAC3 (0.51) HDAC3HDAC1HDAC2HDAC10HDAC6
SCHEMBL14667523 0.80 ALDH1A1 (0.37) HPGDL3MBTL1ALDH1A1MAPTUSP2
SCHEMBL14667444 0.79 ALOX15 (0.45) HPGDL3MBTL1ALDH1A1MAPTHSD17B10
SCHEMBL14667445 0.79 USP2 (0.45) HPGDALDH1A1MAPTHSD17B10USP2

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-8802448-B2 Mixed mode ligands PALL CORPORATION (US) 2014-08-12 — — US disclosed
US-20130030154-A1 MIXED MODE LIGANDS PALL CORPORATION (US) 2013-01-31 — — 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-20130030154-A1 MIXED MODE LIGANDS NCL, NECTIN4, NCLN HDAC3 1717/4885HDAC1 1112/4885HDAC2 2871/4885

“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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