SCHEMBL1443643

SCHEMBL1443643

CC(C)c1ccc(S(=O)(=O)Nc2ccc(Cl)cc2I)cc1

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 9/20 0.62
PGR P06401 1/20 0.51
APP P05067 1/20 0.48
ERBB2 P04626 1/20 0.47
HSP90AA1 P07900 1/20 0.47
HSP90AB1 P08238 1/20 0.47
LMNA P02545 1/20 0.46
ALDH1A1 P00352 1/20 0.46
HSD17B2 P37059 2/20 0.45

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
SCHEMBL12096628 0.88 PGR (0.58) CCR2PGRERBB2HSP90AA1HSP90AB1
SCHEMBL7597807 0.87 CCR2 (0.71) CCR2PGRAPPERBB2HSP90AA1
SCHEMBL28591171 0.85 APP (0.61) CCR2APPLMNAALDH1A1
SCHEMBL2766570 0.82 ERBB2 (0.68) CCR2PGRERBB2HSP90AA1HSP90AB1
SCHEMBL2968297 0.82 HSD17B2 (0.67) CCR2HSD17B2
SCHEMBL1441860 0.81 KDM1A (0.48) CCR2LMNAALDH1A1
SCHEMBL1443646 0.80 FFAR4 (0.52) CCR2APPERBB2HSP90AA1HSP90AB1
SCHEMBL14057177 0.80 CCR2 (0.49) CCR2PGRLMNAALDH1A1
SCHEMBL9933533 0.79 CCR2 (0.81) CCR2PGRHSD17B2
SCHEMBL12096927 0.78 FFAR4 (0.49) CCR2LMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120232070-A1 Use of Indole Derivatives as Nurr-1 Activators for the Application Thereof as a Medicament for the Treatment of Parkinson's Disease LABORATOIRES FOURNIER SA (FR) 2012-09-13 US disclosed
EP-2475642-A1 USE OF INDOLE DERIVATIVES AS NURR-1 ACTIVATORS FOR THE APPLICATION THEREOF AS A MEDICAMENT FOR THE TREATMENT OF PARKINSON'S DISEASE Laboratoires Fournier S.A. (FR) 2012-07-18 EP disclosed
CN-102596906-A Use of indole derivatives as NURR-1 activators as agents for the treatment of Parkinson's disease FOURNIER LAB SA 2012-07-18 CN disclosed
WO-2011030068-A1 USE OF INDOLE DERIVATIVES AS NURR-1 ACTIVATORS FOR THE APPLICATION THEREOF AS A MEDICAMENT FOR THE TREATMENT OF PARKINSON'S DISEASE LABORATOIRES FOURNIER SA (FR) 2011-03-17 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-20120232070-A1 Use of Indole Derivatives as Nurr-1 Activators for the Application Thereof as a Medicament for the Treatment of Parkinson's Disease NCOR1, NR0B1, MTNR1A CCR2 729/4885PGR 712/4885APP 894/4885

“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.