SCHEMBL5656870

SCHEMBL5656870

Cc1c(C(=O)O)c2ccc(Cl)c(Cl)c2n1CCCNS(C)(=O)=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.40
MEN1 O00255 3/20 0.40
KDM4E B2RXH2 2/20 0.37
HSD17B10 Q99714 1/20 0.37
TRPV4 Q9HBA0 1/20 0.36
CNR2 P34972 2/20 0.36
CLK1 P49759 2/20 0.34
TLR7 Q9NYK1 1/20 0.34
POLB P06746 1/20 0.34
TDP1 Q9NUW8 2/20 0.33
CNR1 P21554 1/20 0.33
MCL1 Q07820 1/20 0.33
ATM Q13315 1/20 0.33
VDR P11473 1/20 0.33
PIK3CD O00329 1/20 0.33
PIK3R2 O00459 1/20 0.33
PIK3CG P48736 1/20 0.33
CLK3 P49761 1/20 0.33
DYRK1A Q13627 1/20 0.33
ALDH1A1 P00352 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
SCHEMBL5660343 0.87 MEN1 (0.42) KMT2AMEN1TRPV4CNR2TLR7
SCHEMBL3817863 0.82 CNR2 (0.34) KMT2AMEN1KDM4EHSD17B10TRPV4
SCHEMBL5673140 0.79 TRPV4 (0.40) TRPV4CNR2POLBCNR1
SCHEMBL3810309 0.76 CNR2 (0.58) CNR2CNR1
SCHEMBL476601 0.74 CNR2 (0.38) KMT2AMEN1TRPV4CNR2TLR7
SCHEMBL3820570 0.74 CNR2 (0.34) KMT2AMEN1KDM4EHSD17B10TRPV4
SCHEMBL476619 0.73 ALDH1A1 (0.39) KMT2AMEN1TRPV4CNR2TLR7
SCHEMBL476592 0.73 CNR2 (0.56) TRPV4CNR2TDP1CNR1
SCHEMBL3296756 0.72 CNR2 (0.40) TRPV4CNR2TLR7TDP1CNR1
SCHEMBL5657653 0.72 CNR2 (0.42) KMT2AMEN1KDM4ECNR2TLR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7202268-B2 Derivatives of indole-3-carboxamide, preparation method thereof and application of same in therapeutics SANOFI-AVENTIS (FR) 2007-04-10 US disclosed
US-20050288356-A1 Derivatives of indole-3-carboxamide, preparation method thereof and application of same in therapeutics SANOFI-AVENTIS (FR) 2005-12-29 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-20050288356-A1 Derivatives of indole-3-carboxamide, preparation method thereof and application of same in therapeutics IDO1, IDO2, TDO2 KMT2A 1028/4885MEN1 531/4885KDM4E 1261/4885

“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.