SCHEMBL985744

SCHEMBL985744

Cc1cnc2c(OC(=O)O)c(Cl)ccc2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 2/20 0.50
CCR5 P51681 2/20 0.50
CCR8 P51685 2/20 0.50
PARP1 P09874 1/20 0.43
KDM4E B2RXH2 4/20 0.42
PSMD14 O00487 1/20 0.39
COPS5 Q92905 1/20 0.39
ALK Q9UM73 1/20 0.39
PKM P14618 1/20 0.39
HTT P42858 1/20 0.39
SLC40A1 Q9NP59 3/20 0.37
MCL1 Q07820 1/20 0.36
ALDH1A1 P00352 2/20 0.35
HSD17B10 Q99714 2/20 0.35
NFKBIA P25963 1/20 0.34
SLC22A12 Q96S37 1/20 0.34
KMT2A Q03164 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
CYP1A2 P05177 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
SCHEMBL10756613 0.86 CCR1 (0.47) CCR1CCR5CCR8PARP1KDM4E
SCHEMBL989049 0.85 ALK (0.40) KDM4EPSMD14ALKPKMHTT
SCHEMBL379687 0.84 ALK (0.39) KDM4EPSMD14ALKPKMHTT
SCHEMBL10757954 0.84 CCR1 (0.45) CCR1CCR5CCR8PARP1KDM4E
SCHEMBL10344238 0.82 PARP1 (0.47) PARP1KDM4EPSMD14ALKPKM
SCHEMBL10694131 0.80 ALK (0.36) PARP1KDM4EPSMD14ALKPKM
SCHEMBL10356808 0.80 ALK (0.36) PARP1KDM4EPSMD14ALKPKM
SCHEMBL10357601 0.80 GLA (0.44) ALKHTTALDH1A1KMT2A
SCHEMBL10920276 0.79 KDM4E (0.44) CCR1CCR5CCR8PARP1KDM4E
SCHEMBL377288 0.79 CCR1 (0.38) CCR1CCR5CCR8PARP1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3813532-B1 PROCESS FOR THE PREPARATION OF QUINMERAC ADAMA AGAN LTD (IL) 2024-02-28 EP claimed
EP-1423009-A2 HERBICIDES MADE FROM SUBSTITUTED ARYL KETONES Bayer CropScience AG (DE) 2004-06-02 EP claimed
EP-1423005-A1 HERBICIDAL MIXTURES BASED ON SUBSTITUTED ARYL KETONES Bayer CropScience AG (DE) 2004-06-02 EP claimed
EP-1372395-A1 HERBICIDES BASED ON SUBSTITUTED ARYL KETONES Bayer CropScience AG (DE) 2004-01-02 EP claimed
EP-1351571-A2 SELECTIVE HERBICIDES BASED UPON 2,6-DISUBSTITUTED PYRIDINE DERIVATIVES Bayer CropScience AG (DE) 2003-10-15 EP claimed
WO-2003020033-A1 HERBICIDAL MIXTURES BASED ON SUBSTITUTED ARYL KETONES BAYER CROPSCIENCE AG (DE) 2003-03-13 WO claimed
WO-2003017766-A2 HERBICIDES MADE FROM SUBSTITUTED ARYL KETONES BAYER CROPSCIENCE AG (DE) 2003-03-06 WO claimed
EP-1278413-A2 N-ARYL-URACILE-BASED HERBICIDES Bayer CropScience AG (DE) 2003-01-29 EP claimed
WO-2002071845-A1 HERBICIDES BASED ON SUBSTITUTED ARYL KETONES BAYER CROPSCIENCE AG (DE) 2002-09-19 WO claimed
EP-1233672-A2 SYNERGISTIC HERBICIDAL ACTIVE SUBSTANCE COMBINATIONS Bayer Aktiengesellschaft (DE) 2002-08-28 EP claimed
WO-2001035741-A2 SYNERGISTIC HERBICIDAL ACTIVE SUBSTANCE COMBINATIONS BAYER AKTIENGESELLSCHAFT (DE) 2001-05-25 WO claimed
WO-2001024633-A2 SELECTIVE HERBICIDES BASED ON PYRIMIDINE-DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 2001-04-12 WO claimed
WO-2001022819-A1 SELECTIVE HERBICIDES ON THE BASIS OF N-ARYL-TRIAZOLINE(THI)ONES BAYER AKTIENGESELLSCHAFT (DE) 2001-04-05 WO claimed
EP-0970231-A1 EXPRESSION OF HERBICIDE-BINDING POLYPEPTIDES IN PLANTS TO PRODUCE HERBICIDE TOLERANCE BASF AKTIENGESELLSCHAFT (DE) 2000-01-12 EP claimed
EP-0929221-A1 SELECTIVE HERBICIDES BASED ON ARYLSULPHONYLAMINOCARBONYLTRIAZOLINONES BAYER AG (DE) 1999-07-21 EP claimed
WO-1998042852-A1 EXPRESSION OF HERBICIDE-BINDING POLYPEPTIDES IN PLANTS TO PRODUCE HERBICIDE TOLERANCE BASF AKTIENGESELLSCHAFT (DE) 1998-10-01 WO claimed
WO-1998012923-A1 SELECTIVE HERBICIDES BASED ON ARYLSULPHONYLAMINOCARBONYLTRIAZOLINONES BAYER AKTIENGESELLSCHAFT (DE) 1998-04-02 WO claimed
EP-0282778-B1 PROCESS FOR THE PREPARATION OF 7-CHLORO-QUINOLINE-8-CARBOXYLIC ACIDS BASF Aktiengesellschaft (DE) 1992-05-13 EP claimed
EP-0236273-B1 SYNERGETIC COMPOSITIONS AND PROCESS FOR SELECTIVE WEED KILLING IN CEREALS CIBA-GEIGY AG (CH) 1990-08-08 EP claimed
EP-0236273-A2 Synergetic compositions and process for selective weed killing in cereals CIBA-GEIGY AG (CH) 1987-09-09 EP claimed