SCHEMBL115890

SCHEMBL115890

FC(F)(F)C1(c2cc(Cl)c(Cl)c(Cl)c2)CCNC1

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 20/20 0.37
SLC6A4 P31645 20/20 0.37
SLC6A3 Q01959 20/20 0.37
CYP2D6 P10635 2/20 0.34
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33

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
SCHEMBL18229253 1.00 SLC6A2 (0.37) SLC6A2SLC6A4SLC6A3CYP2D6CYP1A2
SCHEMBL28205007 1.00 SLC6A2 (0.37) SLC6A2SLC6A4SLC6A3CYP2D6CYP1A2
SCHEMBL2180925 0.90 SLC6A2 (0.40) SLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL794941 0.89 SLC6A2 (0.38) SLC6A2SLC6A4SLC6A3CYP2D6CYP1A2
SCHEMBL14844401 0.85 SLC6A4 (0.33) SLC6A2SLC6A4SLC6A3
SCHEMBL115415 0.85 SLC6A4 (0.33) SLC6A2SLC6A4SLC6A3
SCHEMBL14844322 0.85 SLC6A4 (0.33) SLC6A2SLC6A4SLC6A3
SCHEMBL2180437 0.81 SLC6A4 (0.41) SLC6A2SLC6A4SLC6A3CYP2D6CYP3A4
SCHEMBL118703 0.81 TSHR (0.41) SLC6A2SLC6A4SLC6A3CYP2D6CYP3A4
SCHEMBL901681 0.78 OPRM1 (0.40) SLC6A2SLC6A4SLC6A3

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 73 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107835803-A Insecticidal aryl-pyrrolidine alkane, its preparation method and its it is used to prevent and treat the purposes of animal pest as reagent 拜耳作物科学股份公司 2018-03-23 CN claimed
CN-107835803-A Insecticidal aryl-pyrrolidine alkane, its preparation method and its it is used to prevent and treat the purposes of animal pest as reagent 拜耳作物科学股份公司 2018-03-23 CN disclosed
CN-104277032-B PESTICIDAL (HETERO) ARYLPYRROLIDINES 拜耳作物科学公司 2017-04-12 CN disclosed
CN-104603139-B Spirocyclic derivatives as antiparasitic 硕腾服务有限责任公司 2016-12-07 CN disclosed
EP-3095780-A1 PESTICIDAL ARYLPYRROLIDINES Bayer Intellectual Property GmbH (DE) 2016-11-23 EP disclosed
EP-3095780-A1 PESTICIDAL ARYLPYRROLIDINES Bayer Intellectual Property GmbH (DE) 2016-11-23 EP disclosed
WO-2016180802-A1 INSECTICIDAL ARYLPYRROLIDINES, METHOD FOR SYNTHESIZING SAME, AND USE THEREOF AS AGENTS FOR CONTROLLING ANIMAL PESTS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2016-11-17 WO disclosed
WO-2016180802-A1 INSECTICIDAL ARYLPYRROLIDINES, METHOD FOR SYNTHESIZING SAME, AND USE THEREOF AS AGENTS FOR CONTROLLING ANIMAL PESTS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2016-11-17 WO disclosed
US-9375000-B2 Pesticidal arylpyrrolidines BAYER INTELLECTUAL PROPERTY GMBH (DE) 2016-06-28 US disclosed
US-9375000-B2 Pesticidal arylpyrrolidines BAYER INTELLECTUAL PROPERTY GMBH (DE) 2016-06-28 US disclosed
EP-2148853-B1 INSECTICIDAL ARYL PYRROLIDINES BAYER CROPSCIENCE AG (DE) 2012-02-08 EP disclosed
EP-2349994-A1 PESTICIDAL (HETERO) ARYLPYRROLIDINES BAYER CROPSCIENCE AG (DE) 2011-08-03 EP disclosed
WO-2011080211-A1 PESTICIDAL ARYLPYRROLIDINES BAYER CROPSCIENCE AG (DE) 2011-07-07 WO disclosed
US-20110082175-A1 INSECTICIDAL ARYL PYRROLIDINES BAYER CROPSCIENCE AG (DE) 2011-04-07 US disclosed
WO-2010124845-A1 PESTICIDAL ARYLPYRROLIDINES BAYER CROPSCIENCE AG (DE) 2010-11-04 WO disclosed
US-20100216792-A1 Pesticidal arylpyrrolidines BAYER CROPSCIENCE AG (DE) 2010-08-26 US disclosed
US-20100216792-A1 Pesticidal arylpyrrolidines BAYER CROPSCIENCE AG (DE) 2010-08-26 US disclosed
US-20100216792-A1 Pesticidal arylpyrrolidines BAYER CROPSCIENCE AG (DE) 2010-08-26 US disclosed
WO-2010043315-A1 PESTICIDAL (HETERO) ARYLPYRROLIDINES BAYER CROPSCIENCE AG (DE) 2010-04-22 WO disclosed
WO-2010043315-A1 PESTICIDAL (HETERO) ARYLPYRROLIDINES BAYER CROPSCIENCE AG (DE) 2010-04-22 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 (2 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-20110082175-A1 INSECTICIDAL ARYL PYRROLIDINES DDT, ITPR3, CYP51A1 SLC6A2 3973/4885SLC6A4 4372/4885SLC6A3 3251/4885
US-20100216792-A1 Pesticidal arylpyrrolidines DDT, AADAC, AHR SLC6A2 1313/4885SLC6A4 1498/4885SLC6A3 1214/4885

“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.