SCHEMBL3820570

SCHEMBL3820570

Cc1ccc2c(C(=O)NC3CC4CCC(C4)C3)c(C)n(CCCNS(C)(=O)=O)c2c1Cl

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 10/20 0.34
ALDH1A1 P00352 2/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
HTT P42858 2/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
CRHBP P24387 1/20 0.34
CRHR2 Q13324 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
TRPV4 Q9HBA0 1/20 0.33
POLB P06746 1/20 0.32
HTR3E A5X5Y0 3/20 0.32
HTR3B O95264 3/20 0.32
HTR3A P46098 3/20 0.32
HTR3D Q70Z44 3/20 0.32
HTR3C Q8WXA8 3/20 0.32
KDM4E B2RXH2 1/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 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
SCHEMBL3817863 0.93 CNR2 (0.34) CNR2ALDH1A1MEN1KMT2AHTT
SCHEMBL3811696 0.90 CNR2 (0.35) CNR2ALDH1A1MEN1KMT2AHTT
SCHEMBL3812660 0.89 TRPV4 (0.37) CNR2ALDH1A1MEN1KMT2AHTT
SCHEMBL3816120 0.89 HTR3E (0.34) CNR2ALDH1A1MEN1KMT2AHTT
SCHEMBL3815509 0.88 CNR2 (0.38) CNR2TRPV4HTR3EHTR3BHTR3A
SCHEMBL3812492 0.86 TRPV4 (0.35) CNR2ALDH1A1MEN1KMT2AHTT
SCHEMBL3810279 0.84 TRPV4 (0.38) CNR2TRPV4HTR3EHTR3BHTR3A
SCHEMBL3816845 0.84 CNR2 (0.38) CNR2ALDH1A1TRPV4HTR3EHTR3B
SCHEMBL3816564 0.83 CNR2 (0.35) CNR2ALDH1A1MEN1KMT2AHTT
SCHEMBL3814253 0.80 CNR2 (0.58) CNR2CNR1

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
EP-1567150-B1 DERIVATIVES OF INDOLE-3-CARBOXAMIDE, PREPARATION METHOD THEREOF AND APPLICATION OF SAME IN THERAPEUTICS SANOFI AVENTIS (FR) 2009-08-12 EP disclosed
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
EP-1567150-A1 DERIVATIVES OF INDOLE-3-CARBOXAMIDE, PREPARATION METHOD THEREOF AND APPLICATION OF SAME IN THERAPEUTICS Sanofi-Aventis (FR) 2005-08-31 EP disclosed
WO-2004050086-A1 DERIVATIVES OF INDOLE-3-CARBOXAMIDE, PREPARATION METHOD THEREOF AND APPLICATION OF SAME IN THERAPEUTICS SANOFI-AVENTIS (FR) 2004-06-17 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-20050288356-A1 Derivatives of indole-3-carboxamide, preparation method thereof and application of same in therapeutics IDO1, IDO2, TDO2 CNR2 4/4885ALDH1A1 955/4885MEN1 531/4885

“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.