SCHEMBL3737610

SCHEMBL3737610

CCCCCCCCCC(=O)CC(=O)N1CCCCC1C(=O)OCC

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 7/20 0.50
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HSD17B10 Q99714 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL3742096 0.90 FKBP1A (0.54) FKBP1AKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL3731038 0.86 LMNA (0.47) FKBP1AALDH1A1SMN1; SMN2
SCHEMBL3747517 0.86 LMNA (0.47) FKBP1AALDH1A1SMN1; SMN2
SCHEMBL3736446 0.85 ACE (0.49) L3MBTL1
SCHEMBL13041397 0.84 FKBP1A (0.56) FKBP1AKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL8626274 0.81 FKBP1A (0.56) FKBP1AKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL3745290 0.81 ACE (0.53) KDM4EHSD17B10L3MBTL1
SCHEMBL6883997 0.80 FKBP1A (0.53) FKBP1AKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL5496855 0.80 FKBP1A (0.53) FKBP1AKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL5496862 0.80 FKBP1A (0.53) FKBP1AKDM4EALDH1A1HPGDSMN1; 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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100280034-A1 Modulation of pathogenicity QUONOVA, LLC 2010-11-04 US disclosed
US-7338969-B2 Modulation of pathogenicity QUONOVA, LLC (US) 2008-03-04 US disclosed
US-20070208012-A1 Modulation of Pathogenicity QUONOVA, LLC 2007-09-06 US disclosed
US-20070203128-A1 Modulation of Pathogenicity QUONOVA, LLC 2007-08-30 US disclosed
US-20070196340-A1 Modulation of Pathogenicity QUONOVA, LLC 2007-08-23 US disclosed
US-20070197492-A1 Modulation of Pathogenicity QUONOVA, LLC 2007-08-23 US disclosed
US-20070184014-A1 Modulation of Pathogenicity QUONOVA, LLC 2007-08-09 US disclosed
US-20070093534-A1 Modulation of Pathogenicity QUONOVA, LLC 2007-04-26 US disclosed
EP-1622890-A2 BLOCKERS OF THE QUORUM SENSING SYSTEM OF GRAM-NEGATIVE BACTERIA 4SC AG (DE) 2006-02-08 EP disclosed
US-20040235914-A1 Modulation of pathogenicity 4 SC AG (DE) 2004-11-25 US disclosed
WO-2004099175-A2 BLOCKERS OF THE QUORUM SENSING SYSTEM OF GRAM-NEGATIVE BACTERIA 4SC AG (DE) 2004-11-18 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 (8 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-20070197492-A1 Modulation of Pathogenicity ANTXR2, Q6ZSR9, PGLS FKBP1A 2387/4885KDM4E 2482/4885ALDH1A1 4721/4885
US-20070203128-A1 Modulation of Pathogenicity ANTXR2, Q6ZSR9, PGLS FKBP1A 2387/4885KDM4E 2482/4885ALDH1A1 4721/4885
US-20070093534-A1 Modulation of Pathogenicity NR1H4, NR1I3, NR1H2 FKBP1A 3800/4885KDM4E 3854/4885ALDH1A1 3931/4885
US-20040235914-A1 Modulation of pathogenicity Q6ZSR9, CCL11, CFH FKBP1A 4719/4885KDM4E 3241/4885ALDH1A1 4526/4885
US-20070208012-A1 Modulation of Pathogenicity ANTXR2, Q6ZSR9, PGLS FKBP1A 2387/4885KDM4E 2482/4885ALDH1A1 4721/4885
US-20100280034-A1 Modulation of pathogenicity NR1H4, NR1I3, NR1H2 FKBP1A 3800/4885KDM4E 3854/4885ALDH1A1 3931/4885
US-20070184014-A1 Modulation of Pathogenicity ANTXR2, Q6ZSR9, PGLS FKBP1A 2387/4885KDM4E 2482/4885ALDH1A1 4721/4885
US-20070196340-A1 Modulation of Pathogenicity NR1H4, NR1I3, NR1H2 FKBP1A 3800/4885KDM4E 3854/4885ALDH1A1 3931/4885

“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.