SCHEMBL6307281

SCHEMBL6307281

C[C@](Oc1ccc2c(c1-c1ccsc1)CCCC2=O)(c1ccccc1)c1ncc[nH]1

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GABRG2 P18507 1/20 0.32
GABRB3 P28472 1/20 0.32
GABRA5 P31644 1/20 0.32
BRD4 O60885 2/20 0.31
ADRA1D P25100 1/20 0.31
ADRA1A P35348 1/20 0.31
ADRA1B P35368 1/20 0.31
SLC6A9 P48067 1/20 0.30
SIK1 P57059 1/20 0.30
SIK2 Q9H0K1 1/20 0.30
SIK3 Q9Y2K2 1/20 0.30

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
SCHEMBL6300071 0.85 MAPKAPK2 (0.32) GABRG2GABRB3GABRA5BRD4
SCHEMBL6307252 0.85 GABRG2 (0.31) GABRG2GABRB3GABRA5BRD4
SCHEMBL6301962 0.85 CDK2 (0.33) GABRG2GABRB3GABRA5BRD4
SCHEMBL6301321 0.83 LTB4R (0.32) GABRG2GABRB3GABRA5BRD4
SCHEMBL6299627 0.83 BRD4 (0.39) BRD4SLC6A9
SCHEMBL6300176 0.80 BRD4 (0.36) BRD4
SCHEMBL6700648 0.80 LTB4R (0.36) GABRG2GABRB3GABRA5BRD4
SCHEMBL6300110 0.80 LTB4R (0.35) GABRG2GABRB3GABRA5BRD4
Bromide SCHEMBL6300825 0.80 LTB4R (0.35) GABRG2GABRB3GABRA5BRD4
SCHEMBL6299367 0.80 LTB4R (0.35) GABRG2GABRB3GABRA5BRD4ADRA1A

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 GABRG2 4570/4885GABRB3 4124/4885GABRA5 3675/4885

“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.