SCHEMBL12660029

SCHEMBL12660029

O=C(O)CCCC(=O)N(CCCCCCCCSC(c1ccccc1)(c1ccccc1)c1ccccc1)CCCCCCSC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 12/20 0.40
▸ KDM4A O75164 3/20 0.40
▸ KDM4C Q9H3R0 3/20 0.40
▸ KDM5A P29375 1/20 0.40
▸ PHF8 Q9UPP1 1/20 0.40
▸ KDM2A Q9Y2K7 1/20 0.40
▸ MAPT P10636 1/20 0.39
▸ RXFP1 Q9HBX9 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.38
▸ HDAC3 O15379 2/20 0.37
▸ HDAC4 P56524 2/20 0.37
▸ HDAC1 Q13547 2/20 0.37
▸ HDAC7 Q8WUI4 2/20 0.37
▸ HDAC2 Q92769 2/20 0.37
▸ HDAC10 Q969S8 2/20 0.37
▸ HDAC11 Q96DB2 2/20 0.37
▸ HDAC8 Q9BY41 2/20 0.37
▸ HDAC6 Q9UBN7 2/20 0.37
▸ HDAC9 Q9UKV0 2/20 0.37
▸ HDAC5 Q9UQL6 2/20 0.37

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
SCHEMBL17546145 1.00 KIF11 (0.40) KIF11KDM4AKDM4CKDM5APHF8
SCHEMBL26616693 0.87 ACHE (0.48) KIF11
SCHEMBL99452 0.85 DPP4 (0.45) KIF11MAPTHDAC3HDAC4HDAC1
SCHEMBL28482917 0.84 KIF11 (0.50) KIF11MAPTRXFP1ALDH1A1HDAC3
SCHEMBL34262 0.84 KIF11 (0.50) KIF11MAPTRXFP1ALDH1A1HDAC3
SCHEMBL3792783 0.84 KIF11 (0.50) KIF11MAPTRXFP1ALDH1A1HDAC3
SCHEMBL28487494 0.84 KIF11 (0.50) KIF11MAPTRXFP1ALDH1A1HDAC3
SCHEMBL18670133 0.84 KIF11 (0.50) KIF11MAPTRXFP1ALDH1A1HDAC3
SCHEMBL2634426 0.84 KIF11 (0.50) KIF11MAPTRXFP1ALDH1A1HDAC3
SCHEMBL15144366 0.84 KIF11 (0.50) KIF11MAPTRXFP1ALDH1A1HDAC3

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-20110112021-A1 PEGYLATED RECOMBINANT HUMAN GROWTH HORMONE COMPOUNDS ASCENDIS PHARMA AS (DK) 2011-05-12 — — US disclosed
US-20110112021-A1 PEGYLATED RECOMBINANT HUMAN GROWTH HORMONE COMPOUNDS ASCENDIS PHARMA AS (DK) 2011-05-12 — — 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-20110112021-A1 PEGYLATED RECOMBINANT HUMAN GROWTH HORMONE COMPOUNDS GHRHR, GHITM, GHSR KIF11 1716/4885KDM4A 3853/4885KDM4C 4099/4885

“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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