SCHEMBL99144

SCHEMBL99144

O=C(CCCCCSC(c1ccccc1)(c1ccccc1)c1ccccc1)NCCCCCCSC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 16/20 0.50
HDAC3 O15379 14/20 0.50
HDAC1 Q13547 14/20 0.50
HDAC2 Q92769 14/20 0.50
HDAC10 Q969S8 14/20 0.50
HDAC11 Q96DB2 14/20 0.50
HDAC8 Q9BY41 14/20 0.50
HDAC4 P56524 13/20 0.50
HDAC7 Q8WUI4 13/20 0.50
HDAC9 Q9UKV0 13/20 0.50
HDAC5 Q9UQL6 13/20 0.50
LMNA P02545 1/20 0.47
TSHR P16473 1/20 0.47
NCOR2 Q9Y618 1/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46

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
SCHEMBL9978090 0.92 LMNA (0.48) HDAC6HDAC3HDAC1HDAC2HDAC10
SCHEMBL16330567 0.91 EPHX2 (0.48) HDAC6HDAC3HDAC1HDAC2HDAC10
SCHEMBL12917527 0.91 KIF11 (0.50) HDAC6HDAC3HDAC1HDAC2HDAC10
SCHEMBL6909931 0.91 L3MBTL1 (0.46) HDAC6HDAC3HDAC1HDAC2HDAC10
SCHEMBL3158110 0.88 HDAC3 (0.46) HDAC6HDAC3HDAC1HDAC2HDAC10
SCHEMBL23299715 0.87 LMNA (0.52) HDAC6HDAC3HDAC1HDAC2HDAC10
SCHEMBL2806972 0.86 L3MBTL1 (0.43) HDAC6HDAC3HDAC1HDAC2HDAC10
SCHEMBL29455253 0.85 HDAC6 (0.45) HDAC6HDAC3HDAC1HDAC2HDAC10
SCHEMBL12532536 0.84 KIF11 (0.57) HDAC3HDAC1
SCHEMBL16647700 0.84 CYP3A4 (0.48) HDAC6HDAC3HDAC1HDAC2HDAC10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160206702-A1 PEGylated Recombinant Human Growth Hormone Compounds ASCENDIS PHARMA GROWTH DISORDERS DIVISION A/S (DK) 2016-07-21 US disclosed
US-9272048-B2 PEGylated recombinant human growth hormone compounds ASCENDIS PHARMA GROWTH DISORDERS DIVISION A/S (DK) 2016-03-01 US disclosed
US-9272048-B2 PEGylated recombinant human growth hormone compounds ASCENDIS PHARMA GROWTH DISORDERS DIVISION A/S (DK) 2016-03-01 US disclosed
US-20120058084-A1 Interferon Alpha Carrier Prodrugs ASCENDIS PHARMA AS (DK) 2012-03-08 US disclosed
US-20120058084-A1 Interferon Alpha Carrier Prodrugs ASCENDIS PHARMA AS (DK) 2012-03-08 US disclosed
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
WO-2010100220-A1 INTERFERON ALPHA CARRIER PRODRUGS ASCENDIS PHARMA AS (DK) 2010-09-10 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 (3 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 HDAC6 2149/4885HDAC3 1635/4885HDAC1 1390/4885
US-20160206702-A1 PEGylated Recombinant Human Growth Hormone Compounds GHRHR, GHITM, GHSR HDAC6 2149/4885HDAC3 1635/4885HDAC1 1390/4885
US-20120058084-A1 Interferon Alpha Carrier Prodrugs IFNG, IFNAR1, IRF3 HDAC6 2459/4885HDAC3 2149/4885HDAC1 4061/4885

“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.