SCHEMBL1420140

SCHEMBL1420140

CN1CCN(C2CCN(c3cc(C(=O)Nc4cccc(Cl)c4)cc(C(F)(F)F)c3)CC2)CC1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BRAF P15056 6/20 0.54
RAF1 P04049 4/20 0.54
CSF1R P07333 3/20 0.51
LYN P07948 1/20 0.50
ALDH1A1 P00352 1/20 0.50
DDR1 Q08345 2/20 0.49
NTRK2 Q16620 2/20 0.48
NTRK1 P04629 1/20 0.48
RHOC P08134 2/20 0.47
RHOA P61586 2/20 0.47
NPY5R Q15761 1/20 0.45
TEK Q02763 1/20 0.45
NPY2R P49146 1/20 0.45
TRPV4 Q9HBA0 1/20 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
SCHEMBL1420605 0.92 NPY2R (0.51) BRAFRAF1CSF1RDDR1NTRK2
SCHEMBL1962983 0.92 ALDH1A1 (0.58) BRAFRAF1CSF1RLYNALDH1A1
SCHEMBL1420607 0.91 LMNA (0.49) BRAFRAF1CSF1RALDH1A1DDR1
SCHEMBL1420411 0.91 NPY2R (0.52) BRAFRAF1CSF1RDDR1NTRK2
SCHEMBL1420819 0.83 NPY2R (0.53) BRAFRAF1CSF1RALDH1A1NTRK2
SCHEMBL1420505 0.83 DDR1 (0.46) CSF1RALDH1A1DDR1RHOCRHOA
SCHEMBL1419999 0.83 NPC1 (0.57) BRAFRAF1CSF1RALDH1A1RHOC
SCHEMBL1962149 0.83 ALDH1A1 (0.57) BRAFRAF1CSF1RALDH1A1NPY2R
SCHEMBL1420450 0.82 NPY2R (0.54) BRAFRAF1CSF1RNPY2RTRPV4
SCHEMBL1420444 0.82 CSF1R (0.47) BRAFRAF1CSF1RLYNDDR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2011524365-A 2011-09-01 JP claimed
US-20110144107-A1 COMPOUNDS AND COMPOSITIONS USEFUL FOR THE TREATMENT OF MALARIA IRM LLC (BM) 2011-06-16 US claimed
EP-2297097-A2 COMPOUNDS AND COMPOSITIONS USEFUL FOR THE TREATMENT OF MALARIA IRM LLC (BM) 2011-03-23 EP claimed
WO-2009152356-A2 COMPOUNDS AND COMPOSITIONS USEFUL FOR THE TREATMENT OF MALARIA IRM LLC (BM) 2009-12-17 WO claimed
US-20110144107-A1 COMPOUNDS AND COMPOSITIONS USEFUL FOR THE TREATMENT OF MALARIA IRM LLC (BM) 2011-06-16 US disclosed
US-20110144107-A1 COMPOUNDS AND COMPOSITIONS USEFUL FOR THE TREATMENT OF MALARIA IRM LLC (BM) 2011-06-16 US disclosed
EP-2297097-A2 COMPOUNDS AND COMPOSITIONS USEFUL FOR THE TREATMENT OF MALARIA IRM LLC (BM) 2011-03-23 EP disclosed
WO-2009152356-A2 COMPOUNDS AND COMPOSITIONS USEFUL FOR THE TREATMENT OF MALARIA IRM LLC (BM) 2009-12-17 WO disclosed
WO-2009152356-A2 COMPOUNDS AND COMPOSITIONS USEFUL FOR THE TREATMENT OF MALARIA IRM LLC (BM) 2009-12-17 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-20110144107-A1 COMPOUNDS AND COMPOSITIONS USEFUL FOR THE TREATMENT OF MALARIA G6PD, DHFR, SGMS1 BRAF 4383/4885RAF1 3451/4885CSF1R 2076/4885

“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.