SCHEMBL19255255

SCHEMBL19255255

O=C(CCCC1CCCCC1)NC1CCCC1

nearest known ligand 0.79

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.79
SMN1; SMN2 Q16637 1/20 0.71
EPHX1 P07099 5/20 0.61
KMT2A Q03164 2/20 0.61
HDAC3 O15379 2/20 0.61
HDAC1 Q13547 2/20 0.61
HDAC2 Q92769 2/20 0.61
HDAC10 Q969S8 2/20 0.61
HDAC11 Q96DB2 2/20 0.61
HDAC8 Q9BY41 2/20 0.61
HDAC6 Q9UBN7 2/20 0.61
NCOR2 Q9Y618 1/20 0.61
ALDH1A1 P00352 2/20 0.59
EPHX2 P34913 1/20 0.54
NAAA Q02083 1/20 0.52
GAA P10253 2/20 0.51
MEN1 O00255 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49

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
SCHEMBL24673607 1.00 HPGD (0.79) HPGDSMN1; SMN2EPHX1KMT2AHDAC3
SCHEMBL14013741 0.93 HPGD (0.74) HPGDSMN1; SMN2EPHX1KMT2AHDAC3
SCHEMBL23967284 0.90 HPGD (0.65) HPGDSMN1; SMN2EPHX1KMT2AHDAC3
SCHEMBL30846691 0.86 HPGD (0.96) HPGDSMN1; SMN2EPHX1KMT2AHDAC3
SCHEMBL9337868 0.86 SMN1; SMN2 (0.95) HPGDSMN1; SMN2EPHX1KMT2AHDAC3
SCHEMBL28668503 0.86 SMN1; SMN2 (0.95) HPGDSMN1; SMN2EPHX1KMT2AHDAC3
SCHEMBL27192682 0.85 HPGD (0.92) HPGDSMN1; SMN2EPHX1KMT2AHDAC3
SCHEMBL30846600 0.85 HPGD (0.92) HPGDSMN1; SMN2EPHX1KMT2AHDAC3
SCHEMBL38658755 0.84 SMN1; SMN2 (0.91) HPGDSMN1; SMN2EPHX1KMT2AHDAC3
SCHEMBL27192916 0.82 HPGD (0.89) HPGDSMN1; SMN2EPHX1KMT2AHDAC3

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-11247976-B2 Synthetic ligands that modulate the activity of the RhlR quorum sensing receptor WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2022-02-15 US disclosed
US-10322112-B2 Compound combinations for attenuation of bacterial virulence WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2019-06-18 US disclosed
US-20190144407-A1 Synthetic Ligands that Modulate the Activity of the RhlR Quorum Sensing Receptor NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2019-05-16 US disclosed
US-20170231962-A1 Compound Combinations for Attenuation of Bacterial Virulence NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2017-08-17 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 (4 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-20170231962-A1 Compound Combinations for Attenuation of Bacterial Virulence PNISR, PGLS, QRFPR HPGD 1821/4885SMN1; SMN2 4813/4885EPHX1 4526/4885
US-20190144407-A1 Synthetic Ligands that Modulate the Activity of the RhlR Quorum Sensing Receptor AREG, QRFPR, GPR139 HPGD 622/4885SMN1; SMN2 4713/4885EPHX1 2782/4885
US-10322112-B2 Compound combinations for attenuation of bacterial virulence PNISR, BLVRB, PGLS HPGD 1453/4885SMN1; SMN2 4848/4885EPHX1 4332/4885
US-11247976-B2 Synthetic ligands that modulate the activity of the RhlR quorum sensing receptor AREG, QRFPR, GPR139 HPGD 622/4885SMN1; SMN2 4713/4885EPHX1 2782/4885

“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.