SCHEMBL1420128

SCHEMBL1420128

O=C(Nc1ccc(Cl)cc1)c1cc(N2CCC(N3CCCC3)CC2)cc(C(F)(F)F)c1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RHOC P08134 9/20 0.52
RHOA P61586 9/20 0.52
CSF1R P07333 4/20 0.50
TRPV4 Q9HBA0 1/20 0.49
DDR1 Q08345 2/20 0.49
NPY2R P49146 2/20 0.49
HRH3 Q9Y5N1 1/20 0.46
CTNNB1 P35222 1/20 0.45
TCF7L2 Q9NQB0 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
SCHEMBL1420533 0.93 TRPV4 (0.57) CSF1RTRPV4NPY2R
SCHEMBL1420444 0.91 CSF1R (0.47) CSF1RTRPV4DDR1NPY2RHRH3
SCHEMBL1420438 0.90 CYP3A4 (0.54) CSF1RTRPV4DDR1NPY2R
SCHEMBL1420117 0.90 LMNA (0.49) CSF1RTRPV4NPY2R
SCHEMBL1420605 0.89 NPY2R (0.51) RHOCRHOACSF1RDDR1NPY2R
SCHEMBL1961881 0.89 CSF1R (0.47) CSF1RTRPV4DDR1NPY2R
SCHEMBL1420252 0.89 CSF1R (0.47) CSF1RTRPV4DDR1NPY2R
SCHEMBL1420411 0.89 NPY2R (0.52) RHOCRHOACSF1RDDR1NPY2R
SCHEMBL1420327 0.88 TRPV4 (0.48) CSF1RTRPV4NPY2R
SCHEMBL1420492 0.88 CSF1R (0.54) CSF1RTRPV4DDR1

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 8 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

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 RHOC 595/4885RHOA 451/4885CSF1R 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.