SCHEMBL6300294

SCHEMBL6300294

CC(C)(C)c1cccc(OCc2c(O[C@@](C)(c3ccccc3)c3ncc[nH]3)ccc3c2CCCC3=O)c1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SOD1 P00441 1/20 0.39
BRD4 O60885 4/20 0.38
MAOA P21397 4/20 0.35
MAOB P27338 4/20 0.35
GRM2 Q14416 1/20 0.34
HPD P32754 3/20 0.33
LTB4R Q15722 3/20 0.33
LTB4R2 Q9NPC1 3/20 0.33
MRGPRX4 Q96LA9 1/20 0.32
ALOX5 P09917 1/20 0.31
ADRB2 P07550 1/20 0.31
ADRB1 P08588 1/20 0.31
HTR1A P08908 1/20 0.31
ADRB3 P13945 1/20 0.31
TSHR P16473 1/20 0.31
SLC6A4 P31645 1/20 0.31
SIGMAR1 Q99720 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
SCHEMBL6307052 0.93 BRD4 (0.37) BRD4MAOAMAOBLTB4RLTB4R2
SCHEMBL6301296 0.93 BRD4 (0.36) BRD4MAOAMAOBHPDLTB4R
SCHEMBL6300288 0.93 BRD4 (0.38) BRD4MAOAMAOBHPDLTB4R
SCHEMBL6300122 0.92 MAOB (0.39) BRD4MAOAMAOBHPDLTB4R
SCHEMBL6300790 0.92 MAOB (0.39) BRD4MAOAMAOBHPDLTB4R
SCHEMBL6301748 0.91 MAOA (0.37) SOD1BRD4MAOAMAOBHPD
SCHEMBL6299621 0.91 BRD4 (0.35) BRD4MAOAMAOBGRM2HPD
SCHEMBL6957144 0.90 MAOA (0.37) BRD4MAOAMAOBLTB4RLTB4R2
SCHEMBL6306046 0.90 BRD4 (0.35) BRD4MAOAMAOBLTB4RLTB4R2
SCHEMBL6307211 0.89 MAOA (0.33) BRD4MAOAMAOBLTB4RLTB4R2

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-20040044057-A1 5- substituted tetralones as inhibitors of ras farnesyl trransferase WARNER-LAMBERT COMPANY 2004-03-04 US 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 SOD1 4164/4885BRD4 2102/4885MAOA 3197/4885

“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.