SCHEMBL3448583

SCHEMBL3448583

CCCCCCCCC=CCCCCCCCC(=O)Nc1ccncc1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SOAT2 O75908 1/20 0.75
SOAT1 P35610 1/20 0.75
PSMB11 A5LHX3 2/20 0.73
PSMA7 O14818 2/20 0.73
PSMB1 P20618 2/20 0.73
PSMA1 P25786 2/20 0.73
PSMA2 P25787 2/20 0.73
PSMA3 P25788 2/20 0.73
PSMA4 P25789 2/20 0.73
PSMB8 P28062 2/20 0.73
PSMB9 P28065 2/20 0.73
PSMA5 P28066 2/20 0.73
PSMB4 P28070 2/20 0.73
PSMB6 P28072 2/20 0.73
PSMB5 P28074 2/20 0.73
PSMB10 P40306 2/20 0.73
PSMB3 P49720 2/20 0.73
PSMB2 P49721 2/20 0.73
PSMA6 P60900 2/20 0.73
PSMA8 Q8TAA3 2/20 0.73

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
SCHEMBL3448581 1.00 SOAT2 (0.75) SOAT2SOAT1PSMB11PSMA7PSMB1
SCHEMBL13109349 1.00 SOAT2 (0.75) SOAT2SOAT1PSMB11PSMA7PSMB1
SCHEMBL10581544 0.91 HPGD (0.76) SOAT2SOAT1PSMB11PSMA7PSMB1
SCHEMBL16596254 0.91 HPGD (0.76) SOAT2SOAT1PSMB11PSMA7PSMB1
SCHEMBL28347915 0.91 HPGD (0.76) SOAT2SOAT1PSMB11PSMA7PSMB1
SCHEMBL8671160 0.91 HPGD (0.76) SOAT2SOAT1PSMB11PSMA7PSMB1
SCHEMBL11928065 0.90 HPGD (0.78) SOAT2SOAT1PSMB11PSMA7PSMB1
SCHEMBL29379899 0.86 SOAT2 (1.00) SOAT2SOAT1PSMB11PSMA7PSMB1
Oleic Acid Anilide SCHEMBL4143904 0.86 SOAT2 (1.00) SOAT2SOAT1PSMB11PSMA7PSMB1
Oleic Acid Anilide SCHEMBL4143902 0.86 SOAT2 (1.00) SOAT2SOAT1PSMB11PSMA7PSMB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8907109-B2 Methods and systems for treating cell proliferation disorders with psoralen derivatives IMMUNOLIGHT, LLC (US) 2014-12-09 US disclosed
US-8791275-B2 Methods and systems for treating cell proliferation disorders with psoralen derivatives DUKE UNIVERSITY (US) 2014-07-29 US disclosed
US-20130129757-A1 METHODS AND SYSTEMS FOR TREATING CELL PROLIFERATION DISORDERS WITH PSORALEN DERIVATIVES IMMUNOLIGHT, LLC (US) 2013-05-23 US disclosed
US-20130131429-A1 METHODS AND SYSTEMS FOR TREATING CELL PROLIFERATION DISORDERS WITH PSORALEN DERIVATIVES lmmunolight, LLC (US) 2013-05-23 US disclosed
US-8383836-B2 Methods and systems for treating cell proliferation disorders with psoralen derivatives DUKE UNIVERSITY (US) 2013-02-26 US disclosed
WO-2010123996-A1 METHODS AND SYSTEMS FOR TREATING CELL PROLIFERATION DISORDERS WITH PSORALEN DERIVATIVES IMMUNOLIGHT, LLC (US) 2010-10-28 WO disclosed
US-20100266621-A1 METHODS AND SYSTEMS FOR TREATING CELL PROLIFERATION DISORDERS WITH PSORALEN DERIVATIVES DUKE UNIVERSITY (US) 2010-10-21 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 (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-20100266621-A1 METHODS AND SYSTEMS FOR TREATING CELL PROLIFERATION DISORDERS WITH PSORALEN DERIVATIVES CDK20, NFATC1, CDK10 SOAT2 4214/4885SOAT1 3688/4885PSMB11 1300/4885
US-20130131429-A1 METHODS AND SYSTEMS FOR TREATING CELL PROLIFERATION DISORDERS WITH PSORALEN DERIVATIVES CDK20, NFATC1, CDK10 SOAT2 4214/4885SOAT1 3688/4885PSMB11 1300/4885
US-20130129757-A1 METHODS AND SYSTEMS FOR TREATING CELL PROLIFERATION DISORDERS WITH PSORALEN DERIVATIVES CDK20, NFATC1, CDK10 SOAT2 4214/4885SOAT1 3688/4885PSMB11 1300/4885

“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.