SCHEMBL1778181

SCHEMBL1778181

O=C(O)c1sc(Cl)nc1C(F)(F)F

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.55
HPGD P15428 1/20 0.55
TSHR P16473 1/20 0.55
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
MAPT P10636 4/20 0.41
AHR P35869 1/20 0.40
POLB P06746 2/20 0.36
GPR35 Q9HC97 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.34
KDM4E B2RXH2 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
DAO P14920 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
XPO1 O14980 1/20 0.32
NR1H4 Q96RI1 1/20 0.31

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
Hydrochloric Acid SCHEMBL10820945 0.98 ALDH1A1 (0.53) ALDH1A1HPGDTSHRMEN1KMT2A
Hydrazine SCHEMBL9675518 0.96 ALDH1A1 (0.52) ALDH1A1HPGDTSHRMEN1KMT2A
Isopropylamine SCHEMBL10821400 0.90 ALDH1A1 (0.50) ALDH1A1HPGDTSHRMEN1KMT2A
SCHEMBL10822184 0.88 ALDH1A1 (0.45) ALDH1A1HPGDTSHRMEN1KMT2A
SCHEMBL2310145 0.86 MEN1 (0.49) ALDH1A1HPGDTSHRMEN1KMT2A
SCHEMBL10820841 0.86 ALDH1A1 (0.53) ALDH1A1HPGDTSHRMEN1KMT2A
SCHEMBL8551963 0.85 MEN1 (0.48) ALDH1A1HPGDTSHRMEN1KMT2A
SCHEMBL10712503 0.85 MEN1 (0.48) ALDH1A1HPGDTSHRMEN1KMT2A
SCHEMBL10820886 0.83 ALDH1A1 (0.55) ALDH1A1HPGDTSHRMEN1KMT2A
SCHEMBL10712511 0.82 MEN1 (0.43) ALDH1A1HPGDTSHRMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2406216-B1 HALOGENALKYLMETHYLENOXY-PHENYL-SUBSTITUTED KETOENOLS BAYER IP GMBH (DE) 2017-04-19 EP claimed
EP-2334175-B1 PHENYL-SUBSTITUTED BICYCLOOCTANE 1,3 DIONE DERIVATIVES BAYER IP GMBH (DE) 2017-03-01 EP claimed
EP-2635550-B1 PHENYL-SUBSTITUTED BICYCLOOCTANE-1,3-DIONE-DERIVATIVES BAYER IP GMBH (DE) 2016-01-27 EP claimed
EP-2681191-B1 2-ACYLOXY-PYRROLIN-4-ONES BAYER IP GMBH (DE) 2015-09-02 EP claimed
EP-2534147-B1 SPIROHETEROCYCLIC-SUBSTITUTED TETRAMIC ACID DERIVATIVES BAYER IP GMBH (DE) 2015-06-17 EP claimed
EP-1943218-B1 ALKOXYALKYL SPIROCYCLIC TETRAMIC ACIDS AND TETRONIC ACIDS BAYER IP GMBH (DE) 2015-05-06 EP claimed
EP-1552746-B1 Selective heteroaryloxy-acetamide-based herbicides BAYER IP GMBH (DE) 2015-02-11 EP claimed
EP-2243362-B1 Selective heteroaryloxy-acetamide-based herbicides BAYER CROPSCIENCE AG (DE) 2014-12-24 EP claimed
EP-2243361-B1 Selective heteroaryloxy-acetamide-based herbicides BAYER CROPSCIENCE AG (DE) 2014-11-26 EP claimed
EP-2243363-B1 Selective heteroaryloxy-acetamide-based herbicides BAYER CROPSCIENCE AG (DE) 2014-11-26 EP claimed
EP-1303189-B1 ARYL SULFONYL AMINO CARBONYL TRIAZOLE BASED SELECTIVE HERBICIDES BAYER CROPSCIENCE AG (DE) 2005-08-24 EP claimed
EP-1130965-B1 COMBINATIONS OF HERBICIDES AND SAFENERS BAYER CROPSCIENCE GMBH (DE) 2003-10-29 EP claimed
CN-1066313-C Safened herbicidal sulfonamide compositions MONSANTO CO (US) 2001-05-30 CN claimed
CN-1081815-A Safe with pyrazolyl sulfonylureas of activity of weeding MONSANTO CO (US) 1994-02-16 CN claimed
EP-0279239-B1 MICROBICIDES CIBA-GEIGY AG (CH) 1992-11-11 EP claimed
US-5135927-A 2-chloro-4-trifluoromethylthiazol-5-carboxylic acid CIBA-GEIGY CORPORATION (US) 1992-08-04 US claimed
CN-1063015-A Safe herbicidal sulfonamide compositions MONSANTO CO (US) 1992-07-29 CN claimed
US-4992434-A Prevention of infestation of plants by phytopathogenic microorganisms CIBA-GEIGY CORPORATION (US) 1991-02-12 US claimed
US-4417916-A POLYMETHYLENEPOLYPHENYLENE POLYISOCYANATE, POLYUREA, LIGNIN MONSANTO COMPANY (US) 1983-11-29 US claimed
US-4199506-A REDUCES HERBICIDAL INJURY TO PLATNS DUE TO ACETAMIDE HERBICIDES MONSANTO COMPANY (US) 1980-04-22 US claimed