SCHEMBL2359979

SCHEMBL2359979

O=C1c2ccccc2C(=O)N1Cc1sc(Cl)nc1C(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.40
HTT P42858 2/20 0.40
RECQL P46063 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C19 P33261 1/20 0.40
CASP3 P42574 2/20 0.40
ALDH1A1 P00352 3/20 0.39
MEN1 O00255 1/20 0.39
PKM P14618 1/20 0.39
KMT2A Q03164 1/20 0.39
NPSR1 Q6W5P4 1/20 0.38
KDM4E B2RXH2 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
GRM5 P41594 1/20 0.37

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
SCHEMBL2356362 0.72 NFKB1 (0.47) MAPTHTTRECQLCYP1A2CYP3A4
SCHEMBL7666711 0.68 MAPK1 (0.56) MAPTHTTRECQLCYP1A2CYP3A4
SCHEMBL11154445 0.67 TSHR (0.43) MEN1KMT2AKDM4E
SCHEMBL11153799 0.66 MEN1 (0.35) MEN1KMT2A
SCHEMBL23706268 0.65 ALDH1A1 (0.46) MAPTHTTRECQLCYP1A2CYP3A4
SCHEMBL7369247 0.65 MAPT (0.52) MAPTHTTRECQLCYP1A2CYP3A4
SCHEMBL17221828 0.65 MAPT (0.43) MAPTHTTRECQLCYP1A2CYP3A4
SCHEMBL16423309 0.65 CASP3 (0.40) MAPTRECQLCASP3ALDH1A1MEN1
SCHEMBL20529800 0.64 HDAC6 (0.62) MAPT
SCHEMBL11100770 0.64 CA12 (0.58) RECQLCASP3ALDH1A1MEN1PKM

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
EP-3095780-A1 PESTICIDAL ARYLPYRROLIDINES Bayer Intellectual Property GmbH (DE) 2016-11-23 EP disclosed
US-9271499-B2 Pesticidal arylpyrrolidines BAYER INTELLECTUAL PROPERTY GMBH (DE) 2016-03-01 US disclosed
US-9266830-B2 Pesticidal arylpyrrolidines BAYER INTELLECTUAL PROPERTY GMBH (DE) 2016-02-23 US disclosed
US-20150073139-A1 Pesticidal Arylpyrrolidines BAYER CROPSCIENCE AG (DE) 2015-03-12 US disclosed
US-20150011553-A1 Pesticidal Arylpyrrolidines BAYER CROPSCIENCE AG (DE) 2015-01-08 US disclosed
US-8785647-B2 Pesticidal arylpyrrolidines BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-07-22 US disclosed
US-20130310408-A1 Pesticidal Arylpyrrolidines BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-11-21 US disclosed
EP-2349994-A1 PESTICIDAL (HETERO) ARYLPYRROLIDINES BAYER CROPSCIENCE AG (DE) 2011-08-03 EP 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 (3 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-20150011553-A1 Pesticidal Arylpyrrolidines DDT, AADAC, AHR MAPT 4207/4885HTT 1216/4885RECQL 3756/4885
US-20150073139-A1 Pesticidal Arylpyrrolidines DDT, ACHE, QDPR MAPT 3780/4885HTT 1751/4885RECQL 4166/4885
US-20130310408-A1 Pesticidal Arylpyrrolidines DDT, ACHE, QDPR MAPT 3780/4885HTT 1751/4885RECQL 4166/4885

“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.