SCHEMBL1916162

SCHEMBL1916162

O=C(O)CCC(=O)CC1CCCCC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.53
ALDH1A1 P00352 1/20 0.47
HPGD P15428 2/20 0.44
EPHX1 P07099 1/20 0.44
KMT2A Q03164 1/20 0.44
EPHX2 P34913 3/20 0.41
PHF8 Q9UPP1 4/20 0.40
KDM2A Q9Y2K7 4/20 0.40
KDM5A P29375 3/20 0.40
KDM4C Q9H3R0 2/20 0.40
KDM4A O75164 1/20 0.40
GABRR1 P24046 1/20 0.39
EGLN1 Q9GZT9 2/20 0.39
ALKBH5 Q6P6C2 1/20 0.39
SUCNR1 Q9BXA5 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
ACE P12821 1/20 0.38
SLC1A3 P43003 2/20 0.37
SLC1A2 P43004 2/20 0.37

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
SCHEMBL2030903 0.98 LMNA (0.50) LMNAALDH1A1HPGDEPHX1KMT2A
SCHEMBL2032466 0.89 LMNA (0.45) LMNAALDH1A1PHF8KDM2AKDM5A
SCHEMBL1148328 0.81 EPHX1 (0.54) HPGDEPHX1KMT2AEPHX2NPC1
SCHEMBL7945281 0.81 EPHX1 (0.54) HPGDEPHX1KMT2AEPHX2NPC1
SCHEMBL8106988 0.81 HPGD (0.42) LMNAHPGDEPHX1KMT2AEPHX2
SCHEMBL8535268 0.81 HPGD (0.42) LMNAALDH1A1HPGDEPHX1KMT2A
SCHEMBL3972455 0.80 EPHX1 (0.50) LMNAALDH1A1HPGDEPHX1KMT2A
SCHEMBL14679380 0.79 EPHX1 (0.52) LMNAALDH1A1HPGDEPHX1KMT2A
SCHEMBL175425 0.79 EPHX1 (0.52) LMNAALDH1A1HPGDEPHX1KMT2A
SCHEMBL6946772 0.79 EPHX1 (0.52) LMNAALDH1A1HPGDEPHX1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110230477-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING METABOLIC DISORDERS EUROSCREEN S.A. (BE) 2011-09-22 US disclosed
WO-2011076734-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING INFLAMMATORY DISEASES EUROSCREEN S.A. (BE) 2011-06-30 WO disclosed
WO-2011076732-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING GASTROINTESTINAL DISORDERS EUROSCREEN S.A. (BE) 2011-06-30 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 (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-20110230477-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING METABOLIC DISORDERS CPT1A, LIPC, PC LMNA 2376/4885ALDH1A1 623/4885HPGD 522/4885

“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.