SCHEMBL3122385

SCHEMBL3122385

COc1ccc(CC(O)(Cc2ccc(OC)cc2)C(Cl)(Cl)Cl)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CALM1 P0DP23 1/20 0.47
IDO1 P14902 3/20 0.45
NR3C1 P04150 1/20 0.45
ALOX15 P16050 2/20 0.43
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 1/20 0.43
MAPT P10636 1/20 0.43
CMA1 P23946 1/20 0.43
AGXT P21549 2/20 0.42
LTA4H P09960 1/20 0.42
TAAR1 Q96RJ0 1/20 0.42
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
CA14 Q9ULX7 1/20 0.42
IGF1R P08069 1/20 0.42
HTT P42858 2/20 0.42
LMNA P02545 1/20 0.42

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
SCHEMBL3655846 0.79 IDO1 (0.52) IDO1ALOX15ALDH1A1KDM4EMAPT
SCHEMBL26695481 0.79 IDO1 (0.54) CALM1IDO1ALOX15ALDH1A1AGXT
SCHEMBL11596580 0.79 IDO1 (0.52) CALM1IDO1ALOX15ALDH1A1KDM4E
SCHEMBL809115 0.78 IDO1 (0.50) CALM1IDO1NR3C1ALOX15ALDH1A1
SCHEMBL11132376 0.78 IDO1 (0.50) CALM1IDO1NR3C1ALOX15ALDH1A1
SCHEMBL2875596 0.77 IDO1 (0.45) CALM1IDO1ALOX15ALDH1A1KDM4E
SCHEMBL11336433 0.76 IDO1 (0.50) CALM1IDO1ALDH1A1AGXTLTA4H
SCHEMBL16424752 0.74 IDO1 (0.56) CALM1IDO1ALOX15ALDH1A1KDM4E
SCHEMBL5521328 0.74 IDO1 (0.47) CALM1IDO1ALOX15ALDH1A1AGXT
SCHEMBL9839441 0.74 HTT (0.54) CALM1IDO1ALDH1A1AGXTLTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3268353-B1 PYRAZOLYL DERIVATIVES AS PEST CONTROL AGENTS BAYER ANIMAL HEALTH GMBH (DE) 2020-09-09 EP disclosed
EP-3157913-B1 PYRAZOLYL TRIAZOLYL PYRIDINES AS PESTICIDE BAYER ANIMAL HEALTH GMBH (DE) 2019-04-17 EP disclosed
EP-3089972-B1 NOVEL PYRAZOLE HETEROARYLAMIDES AS PESTICIDES BAYER ANIMAL HEALTH GMBH (DE) 2018-05-16 EP disclosed
EP-2953942-B1 HALOGEN-SUBSTITUTED PYRAZOLE DERIVATIVES AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2017-10-25 EP disclosed
EP-2794573-B1 NOVEL INSECTICIDAL AROMATIC AMIDES BAYER IP GMBH (DE) 2017-08-30 EP disclosed
EP-2964631-B1 HALOGEN-SUBSTITUTED N-[3-(1H-PYRAZOL-4-YL)PHENYLMETHYL]-SULFONAMIDE DERIVATIVES AND RELATED COMPOUNDS AS PESTICIDES FOR USE IN CROP PROTECTION IN VETERINARY MEDICINE AND IN MATERIAL PROTECTION BAYER ANIMAL HEALTH GMBH (DE) 2017-08-30 EP disclosed
EP-2964632-B1 HALOGEN SUBSTITUTED 1H-PYRAZOLE DERIVATIVES AS INSECTICIDES BAYER CROPSCIENCE AG (DE) 2016-12-14 EP disclosed
EP-2352723-B1 PESTICIDAL N-ARYL- OR N-HETEROARYL PYRAZOLE CARBOXAMIDE COMPOUNDS BAYER IP GMBH (DE) 2016-11-23 EP disclosed
EP-2686303-B1 N-(3-CARBAMOYLPHENYL)-1H-PYRAZOLE-5-CARBOXAMIDE DERIVATIVES AND THEIR USE FOR COMBATING ANIMAL PESTS BAYER IP GMBH (DE) 2016-01-20 EP disclosed
EP-2964631-A1 NOVEL HALOGEN-SUBSTITUTED COMPOUNDS Bayer Animal Health GmbH (DE) 2016-01-13 EP disclosed
WO-2014135439-A1 NOVEL HALOGEN-SUBSTITUTED COMPOUNDS BAYER CROPSCIENCE AG (DE) 2014-09-12 WO disclosed
EP-2686303-A1 N-(3-CARBAMOYLPHENYL)-1H-PYRAZOLE-5-CARBOXAMIDE DERIVATIVES AND THE USE THEREOF FOR CONTROLLING ANIMAL PESTS Bayer Intellectual Property GmbH (DE) 2014-01-22 EP disclosed
WO-2012126766-A1 N-(3-CARBAMOYLPHENYL)-1H-PYRAZOLE-5-CARBOXAMIDE DERIVATIVES AND THE USE THEREOF FOR CONTROLLING ANIMAL PESTS BAYER CROPSCIENCE AG (DE) 2012-09-27 WO disclosed
EP-2054427-B1 AVERMECTIN DERIVATIVES BAYER CROPSCIENCE AG (DE) 2010-07-14 EP disclosed
EP-2184273-A1 Halogen substituted compounds as pesticides Bayer CropScience AG (DE) 2010-05-12 EP disclosed
WO-2009141096-A1 SUBSTITUTED SPIRO-ISOXAZOLINES BAYER CROPSCIENCE AG (DE) 2009-11-26 WO disclosed
EP-2054427-A2 AVERMECTIN DERIVATIVES Bayer CropScience AG (DE) 2009-05-06 EP disclosed
WO-2008019784-A2 AVERMECTIN DERIVATIVES BAYER CROPSCIENCE AG (DE) 2008-02-21 WO disclosed
EP-1412346-B1 METHOD FOR PRODUCING NOVEL SPINOSYN DERIVATIVES BAYER CROPSCIENCE AG (DE) 2005-03-09 EP disclosed