SCHEMBL13855987

SCHEMBL13855987

CC(C)(C)OC(=O)NCCCC(=O)On1nnc2ccccc21

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 5/20 0.51
▸ BCHE P06276 1/20 0.49
▸ HDAC3 O15379 3/20 0.45
▸ HDAC4 P56524 3/20 0.45
▸ HDAC1 Q13547 3/20 0.45
▸ HDAC7 Q8WUI4 3/20 0.45
▸ HDAC2 Q92769 3/20 0.45
▸ HDAC10 Q969S8 3/20 0.45
▸ HDAC11 Q96DB2 3/20 0.45
▸ HDAC8 Q9BY41 3/20 0.45
▸ HDAC6 Q9UBN7 3/20 0.45
▸ HDAC9 Q9UKV0 3/20 0.45
▸ HDAC5 Q9UQL6 3/20 0.45
▸ ASAH1 Q13510 1/20 0.44
▸ SIGMAR1 Q99720 1/20 0.44
▸ TPSAB1 Q15661 1/20 0.43
▸ TPSD1 Q9BZJ3 1/20 0.43
▸ TPSG1 Q9NRR2 1/20 0.43
▸ SIRT2 Q8IXJ6 2/20 0.43
▸ NPC1 O15118 1/20 0.42

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
SCHEMBL10090133 0.86 BRD4 (0.48) BRD4BCHEHDAC3HDAC4HDAC1
SCHEMBL1609731 0.82 HDAC3 (0.45) BRD4BCHEHDAC3HDAC4HDAC1
SCHEMBL11752297 0.81 SIRT2 (0.56) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL4952678 0.81 SIRT2 (0.56) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL17742912 0.81 CYP3A4 (0.48) BRD4BCHETPSAB1TPSD1TPSG1
SCHEMBL2216539 0.80 SIRT2 (0.55) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL10090132 0.80 BCHE (0.45) BRD4BCHEHDAC3HDAC4HDAC1
SCHEMBL17763229 0.80 BRD4 (0.55) BRD4BCHEASAH1DRD2
SCHEMBL13782023 0.79 CYP4Z1 (0.51) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL29964193 0.78 BCHE (0.49) BRD4BCHENPC1RAB9ASMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090124832-A1 OLIGOAMINE COMPOUNDS AND DERIVATIVES THEREOF FOR CANCER THERAPY PROGEN PHARMACEUTICALS, INC. (US) 2009-05-14 — — US disclosed
US-20090124832-A1 OLIGOAMINE COMPOUNDS AND DERIVATIVES THEREOF FOR CANCER THERAPY PROGEN PHARMACEUTICALS, INC. (US) 2009-05-14 — — US disclosed
US-7491849-B2 Oligoamine compounds and derivatives thereof for cancer therapy PROGEN PHARMACEUTICALS, INC. (US) 2009-02-17 — — US disclosed
US-7491849-B2 Oligoamine compounds and derivatives thereof for cancer therapy PROGEN PHARMACEUTICALS, INC. (US) 2009-02-17 — — 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-20090124832-A1 OLIGOAMINE COMPOUNDS AND DERIVATIVES THEREOF FOR CANCER THERAPY THOP1, OAT, DUT BRD4 900/4885BCHE 2657/4885HDAC3 794/4885

“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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