SCHEMBL3303465

SCHEMBL3303465

Cc1c(C(=O)C2(c3ccccc3F)CCCC2)c2cccc(Cl)c2n1CCCNS(C)(=O)=O

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.39
TRPV4 Q9HBA0 1/20 0.35
HDAC4 P56524 4/20 0.35
LMNA P02545 2/20 0.35
TDP1 Q9NUW8 2/20 0.34
P2RX7 Q99572 1/20 0.34
CCR1 P32246 1/20 0.33
MAPT P10636 1/20 0.33
TLR7 Q9NYK1 1/20 0.33
HTR2A P28223 2/20 0.33
HTR2C P28335 2/20 0.33
SLC6A4 P31645 2/20 0.33
ITGB1 P05556 1/20 0.33
ITGA4 P13612 1/20 0.33
ALDH1A1 P00352 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HDAC9 Q9UKV0 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL3298972 0.90 CNR2 (0.39) CNR2TRPV4HDAC4LMNATDP1
SCHEMBL3296904 0.89 CNR2 (0.41) CNR2TRPV4TDP1CCR1TLR7
SCHEMBL3301795 0.88 CNR2 (0.42) CNR2TRPV4TDP1P2RX7CCR1
SCHEMBL3296756 0.85 CNR2 (0.40) CNR2TRPV4TDP1CCR1TLR7
SCHEMBL5660343 0.79 MEN1 (0.42) CNR2TRPV4TDP1TLR7
SCHEMBL476610 0.78 CNR2 (0.45) CNR2TRPV4LMNAMAPT
SCHEMBL476543 0.77 CNR2 (0.52) CNR2TRPV4LMNAL3MBTL1
SCHEMBL476592 0.76 CNR2 (0.56) CNR2TRPV4TDP1
SCHEMBL476654 0.75 P2RX7 (0.38) CNR2TRPV4P2RX7
SCHEMBL476601 0.75 CNR2 (0.38) CNR2TRPV4TDP1TLR7

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-20080275102-A1 3-ACYLINDOLE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2008-11-06 US claimed
US-7741363-B2 3-Acylindole derivatives, preparation and therapeutic use thereof SANOFI-AVENTIS (FR) 2010-06-22 US disclosed
US-20080275102-A1 3-ACYLINDOLE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2008-11-06 US disclosed
EP-1951225-A2 3-ACYLINDOLE DERIVATIVES THE PREPARATION AND THE THERAPEUTIC USE THEREOF sanofi-aventis (FR) 2008-08-06 EP disclosed
WO-2007057571-A2 3-ACYLINDOLE DERIVATIVES THE PREPARATION AND THE THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2007-05-24 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-20080275102-A1 3-ACYLINDOLE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF F12, ECI1, NQO2 CNR2 31/4885TRPV4 4134/4885HDAC4 912/4885

“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.