SCHEMBL21779547

SCHEMBL21779547

CCN(C)/C=N/c1cc(C)c(Oc2ccccc2Cl)cc1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 6/20 0.41
SLC6A4 P31645 6/20 0.41
SLC6A3 Q01959 6/20 0.41
AR P10275 1/20 0.33
CXCL8 P10145 1/20 0.32
CYP3A4 P08684 1/20 0.32
ADRA2A P08913 1/20 0.32
LPAR1 Q92633 1/20 0.31
LPAR5 Q9H1C0 1/20 0.31
CAMK2A Q9UQM7 1/20 0.31
HPGD P15428 2/20 0.31
L3MBTL1 Q9Y468 2/20 0.31
MEN1 O00255 1/20 0.31
HSP90AA1 P07900 1/20 0.31
MAPK1 P28482 1/20 0.31
KMT2A Q03164 1/20 0.31
MAPT P10636 2/20 0.30
RHEB Q15382 1/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL18320702 0.93 SLC6A2 (0.41) SLC6A2SLC6A4SLC6A3ARCXCL8
SCHEMBL20211508 0.93 SLC6A2 (0.41) SLC6A2SLC6A4SLC6A3ARCXCL8
SCHEMBL18320704 0.93 SLC6A2 (0.41) SLC6A2SLC6A4SLC6A3ARCXCL8
SCHEMBL20211509 0.93 SLC6A2 (0.41) SLC6A2SLC6A4SLC6A3ARCXCL8
SCHEMBL21779530 0.90 SLC6A2 (0.39) SLC6A2SLC6A4SLC6A3ARCXCL8
SCHEMBL20521440 0.90 SLC6A2 (0.39) SLC6A2SLC6A4SLC6A3CYP3A4HPGD
SCHEMBL18321228 0.90 SLC6A2 (0.39) SLC6A2SLC6A4SLC6A3ARCXCL8
SCHEMBL22176881 0.90 SLC6A2 (0.39) SLC6A2SLC6A4SLC6A3CYP3A4HPGD
SCHEMBL18321227 0.90 SLC6A2 (0.39) SLC6A2SLC6A4SLC6A3ARCXCL8
SCHEMBL20521443 0.90 SLC6A2 (0.39) SLC6A2SLC6A4SLC6A3CYP3A4HPGD

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-20200205406-A1 MICROBIOCIDAL PHENYLAMIDINE DERIVATIVES WITH IMPROVED PLANT SAFETY PROPERTIES SYNGENTA PARTICIPATIONS AG (CH) 2020-07-02 US disclosed
EP-3616515-A1 COMPOSITION FOR CONTROLLING PLANT DISEASES AND METHOD FOR CONTROLLING PLANT DISEASES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2020-03-04 EP 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-20200205406-A1 MICROBIOCIDAL PHENYLAMIDINE DERIVATIVES WITH IMPROVED PLANT SAFETY PROPERTIES ARG1, MSR1, PADI1 SLC6A2 2933/4885SLC6A4 2722/4885SLC6A3 2814/4885

“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.