SCHEMBL3875446

SCHEMBL3875446

CCNC(=O)CCCNC(=O)CCCNC(=O)CCCNC(=O)CCCNC(=O)OC(C)(C)C

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CAPN1 P07384 1/20 0.61
TDP1 Q9NUW8 1/20 0.56
CA1 P00915 6/20 0.54
CA2 P00918 6/20 0.54
MEN1 O00255 1/20 0.53
GAA P10253 1/20 0.53
KMT2A Q03164 1/20 0.53
MAOA P21397 1/20 0.49
MAOB P27338 1/20 0.49
CYP3A4 P08684 1/20 0.47
CA12 O43570 2/20 0.47
CA9 Q16790 2/20 0.47
FAAH O00519 1/20 0.46
TSHR P16473 1/20 0.43
HDAC3 O15379 1/20 0.43
HDAC4 P56524 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC7 Q8WUI4 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC10 Q969S8 1/20 0.43

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
SCHEMBL3884455 1.00 CAPN1 (0.61) CAPN1TDP1CA1CA2MEN1
SCHEMBL3882611 1.00 CAPN1 (0.61) CAPN1TDP1CA1CA2MEN1
SCHEMBL3882948 0.98 CAPN1 (0.63) CAPN1TDP1CA1CA2MEN1
SCHEMBL13480197 0.89 TDP1 (0.58) CAPN1TDP1CA1CA2MEN1
SCHEMBL12418238 0.87 TDP1 (0.65) CAPN1TDP1CA1CA2MEN1
SCHEMBL7207224 0.86 TDP1 (0.69) CAPN1TDP1CA1CA2MEN1
SCHEMBL28676999 0.85 CA1 (0.56) CAPN1TDP1CA1CA2MEN1
SCHEMBL15858238 0.85 TDP1 (0.63) CAPN1TDP1CA1CA2MEN1
SCHEMBL31108264 0.85 CA1 (0.56) CAPN1TDP1CA1CA2MEN1
SCHEMBL20922191 0.84 MAOA (0.55) CAPN1TDP1CA1CA2MEN1

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 5 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-7491849-B2 Oligoamine compounds and derivatives thereof for cancer therapy PROGEN PHARMACEUTICALS, INC. (US) 2009-02-17 US disclosed
US-20050080144-A1 Oligoamine compounds and derivatives thereof for cancer therapy PROGEN PHARMACEUTICALS, INC. 2005-04-14 US disclosed
EP-1436246-A1 OLIGOAMINE COMPOUNDS AND DERIVATIVES THEREOF FOR CANCER THERAPY SLIL Biomedical Corporation (US) 2004-07-14 EP disclosed
WO-2003033455-A1 OLIGOAMINE COMPOUNDS AND DERIVATIVES THEREOF FOR CANCER THERAPY SLIL BIOMEDICAL CORPORATION (US) 2003-04-24 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 (2 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-20050080144-A1 Oligoamine compounds and derivatives thereof for cancer therapy THOP1, OAT, DUT CAPN1 3206/4885TDP1 659/4885CA1 4403/4885
US-20090124832-A1 OLIGOAMINE COMPOUNDS AND DERIVATIVES THEREOF FOR CANCER THERAPY THOP1, OAT, DUT CAPN1 3206/4885TDP1 659/4885CA1 4403/4885

“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.