SCHEMBL6300288

SCHEMBL6300288

Cc1cccc(OCc2c(O[C@@](C)(c3ccccc3)c3ncc[nH]3)ccc3c2CCCC3=O)c1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 5/20 0.38
HPD P32754 2/20 0.35
MAOB P27338 5/20 0.34
MAOA P21397 4/20 0.34
GRM5 P41594 1/20 0.33
LTB4R Q15722 1/20 0.32
LTB4R2 Q9NPC1 1/20 0.32
HTT P42858 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
MRGPRX4 Q96LA9 1/20 0.32
LMNA P02545 1/20 0.32
HRH3 Q9Y5N1 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31

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
SCHEMBL6300294 0.93 SOD1 (0.39) BRD4HPDMAOBMAOALTB4R
SCHEMBL6307052 0.93 BRD4 (0.37) BRD4MAOBMAOAGRM5LTB4R
SCHEMBL6301296 0.92 BRD4 (0.36) BRD4HPDMAOBMAOALTB4R
SCHEMBL6300122 0.91 MAOB (0.39) BRD4HPDMAOBMAOAGRM5
SCHEMBL6300790 0.91 MAOB (0.39) BRD4HPDMAOBMAOAGRM5
SCHEMBL6299516 0.91 MAOA (0.37) BRD4HPDMAOBMAOAGRM5
SCHEMBL6301748 0.91 MAOA (0.37) BRD4HPDMAOBMAOALTB4R
SCHEMBL6299621 0.90 BRD4 (0.35) BRD4HPDMAOBMAOALTB4R
SCHEMBL6957144 0.90 MAOA (0.37) BRD4MAOBMAOALTB4RLTB4R2
SCHEMBL6306046 0.90 BRD4 (0.35) BRD4MAOBMAOAGRM5LTB4R

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-20040044057-A1 5- substituted tetralones as inhibitors of ras farnesyl trransferase WARNER-LAMBERT COMPANY 2004-03-04 US claimed
EP-1276725-A2 5-SUBSTITUTED TETRALONES AS INHIBITORS OF RAS FARNESYL TRANSFERASE WARNER-LAMBERT COMPANY (US) 2003-01-22 EP claimed
WO-2001079180-A2 5-SUBSTITUTED TETRALONES AS INHIBITORS OF RAS FARNESYL TRANSFERASE WARNER-LAMBERT COMPANY (US) 2001-10-25 WO claimed
US-6943183-B2 5-substituted tetralones as inhibitors of ras farnesyl transferase PFIZER INC (US) 2005-09-13 US disclosed
US-20040044057-A1 5- substituted tetralones as inhibitors of ras farnesyl trransferase WARNER-LAMBERT COMPANY 2004-03-04 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 (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-20040044057-A1 5- substituted tetralones as inhibitors of ras farnesyl trransferase PTAR1, FNTA, GGPS1 BRD4 2102/4885HPD 2326/4885MAOB 2947/4885

“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.