SCHEMBL2179928

SCHEMBL2179928

FC(F)(F)C1(c2cccc(Cl)c2)CCNC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 8/20 0.38
SLC6A3 Q01959 6/20 0.38
HTR2A P28223 3/20 0.38
PDK2 Q15119 3/20 0.36
SLC6A2 P23975 4/20 0.35
HTR2C P28335 4/20 0.35
HTR2B P41595 2/20 0.35
CHRNA1 P02708 2/20 0.35
CHRNG P07510 2/20 0.35
CHRNB1 P11230 2/20 0.35
CHRNB2 P17787 2/20 0.35
CHRNB4 P30926 2/20 0.35
CHRNA3 P32297 2/20 0.35
CHRNA4 P43681 2/20 0.35
CHRND Q07001 2/20 0.35
TACR1 P25103 2/20 0.34
KCNH2 Q12809 2/20 0.34
HTR3E A5X5Y0 1/20 0.34
HTR3B O95264 1/20 0.34
TP53 P04637 1/20 0.34

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
SCHEMBL14844401 0.84 SLC6A4 (0.33) SLC6A4SLC6A3HTR2ASLC6A2HTR2C
SCHEMBL115415 0.84 SLC6A4 (0.33) SLC6A4SLC6A3HTR2ASLC6A2HTR2C
SCHEMBL14844322 0.84 SLC6A4 (0.33) SLC6A4SLC6A3HTR2ASLC6A2HTR2C
SCHEMBL2180201 0.82 HTR2A (0.38) SLC6A4SLC6A3HTR2APDK2SLC6A2
SCHEMBL2179101 0.82 KDM1A (0.45) SLC6A4SLC6A3SLC6A2HTR2CTACR1
SCHEMBL28775360 0.80 HTR2A (0.53) SLC6A4HTR2ASLC6A2HTR2CTACR1
SCHEMBL901681 0.78 OPRM1 (0.40) SLC6A4SLC6A3PDK2SLC6A2HTR2C
SCHEMBL2180437 0.78 SLC6A4 (0.41) SLC6A4SLC6A3SLC6A2TACR1KCNH2
SCHEMBL18229253 0.76 SLC6A2 (0.37) SLC6A4SLC6A3SLC6A2CYP1A2CYP3A4
SCHEMBL115890 0.76 SLC6A2 (0.37) SLC6A4SLC6A3SLC6A2CYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2519499-B1 PESTICIDAL ARYLPYRROLIDINES BAYER IP GMBH (DE) 2013-09-18 EP disclosed
US-8536201-B2 Pesticidal arylpyrrolidines BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-09-17 US disclosed
CN-102844299-A Pesticidal arylpyrrolidines BAYER CROPSCIENCE AG 2012-12-26 CN disclosed
US-20120322833-A1 Pesticidal Arylpyrrolidines BAYER INTELLECTUAL PROPERTY GMBH (DE) 2012-12-20 US disclosed
EP-2519499-A1 PESTICIDAL ARYLPYRROLIDINES Bayer Intellectual Property GmbH (DE) 2012-11-07 EP disclosed
WO-2011080211-A1 PESTICIDAL ARYLPYRROLIDINES BAYER CROPSCIENCE AG (DE) 2011-07-07 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-20120322833-A1 Pesticidal Arylpyrrolidines DDT, CYP4X1, CHRM2 SLC6A4 2061/4885SLC6A3 1448/4885HTR2A 2376/4885

“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.