SCHEMBL1829756

SCHEMBL1829756

OCc1cc(C(F)(F)F)[nH]n1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 2/20 0.42
▸ TP53 P04637 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ HPGD P15428 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ RBP4 P02753 1/20 0.33
▸ NOTUM Q6P988 3/20 0.32
▸ DHODH Q02127 1/20 0.30
▸ CFTR P13569 1/20 0.30
▸ CACNA1I Q9P0X4 1/20 0.30
▸ MCL1 Q07820 1/20 0.30

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
SCHEMBL18695578 0.84 HPGD (0.31) ALOX15TP53MAPK1HSD17B10HPGD
Hydrochloric Acid SCHEMBL23120669 0.79 LOXL2 (0.39) ALOX15TP53MAPK1HSD17B10HPGD
SCHEMBL5444047 0.79 STK25 (0.35) HPGDSMN1; SMN2
SCHEMBL7999472 0.79 ALOX15 (0.39) ALOX15TP53MAPK1HSD17B10HPGD
SCHEMBL28189583 0.79 ALOX15 (0.39) ALOX15TP53MAPK1HSD17B10HPGD
SCHEMBL24915517 0.78 KDM5A (0.34) —
SCHEMBL30930296 0.73 ALOX15 (0.37) ALOX15TP53MAPK1HSD17B10HPGD
Hydrochloric Acid SCHEMBL25180560 0.71 — —
SCHEMBL1531092 0.71 ALOX15 (0.55) ALOX15TP53MAPK1HSD17B10HPGD
SCHEMBL28309056 0.71 ALOX15 (0.33) ALOX15TP53MAPK1HSD17B10HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2318374-A2 INSECTICIDAL BENZENEDICARBOXAMIDE DERIVATIVE Bayer CropScience AG (DE) 2011-05-11 — — EP disclosed
WO-2010012442-A2 INSECTICIDAL BENZENEDICARBOXAMIDE DERIVATIVE BAYER CROPSCIENCE AG (DE) 2010-02-04 — — WO disclosed
WO-2005037839-A1 NORCANTHARIDIN DERIVATIVE COMPOUNDS, METHOD FOR THE PRODUCTION THEREOF, COMPOSITIONS CONTAINING SAID COMPOUNDS AND THE USE THEREOF ENTOMED (FR) 2005-04-28 — — WO disclosed
EP-1503998-A1 HETEROARYL SUBSTITUTED SPIROCYCLIC SUFAMIDES FOR INHIBITION OF GAMMA SECRETASE MERCK SHARP & DOHME LTD. (GB) 2005-02-09 — — EP disclosed
WO-2003093252-A1 HETEROARYL SUBSTITUTED SPIROCYCLIC SULFAMIDES FOR INHIBITION OF GAMMA SECRETASE MERCK SHARP & DOHME LIMITED (GB) 2003-11-13 — — WO disclosed
WO-2000071536-A1 HETEROARYLOXYPYRIMIDINE INSECTICIDES AND ACARICIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 2000-11-30 — — WO disclosed
CN-1025141-C Herbicidal compositions containing 5-heterocycle substituted oxazolidine dihaloacetamide antidotes and uses thereof MONSANTO CO (US) 1994-06-29 — — CN disclosed
US-5256626-A Herbicidal compositions safened by 5-heterocyclic-substituted oxazolidine dihaloacetamides compounds MONSANTO COMPANY (US) 1993-10-26 — — US disclosed
US-5225570-A Plant safening agents for crops treated with herbicides MONSANTO COMPANY (US) 1993-07-06 — — US disclosed
EP-0304409-B1 5-HETEROCYCLIC-SUBSTITUTED OXAZOLIDINE HALOACETAMIDES MONSANTO CO (US) 1992-10-28 — — EP disclosed
CN-1031375-A The  oxazolidine dihaloacetamides class of 5-heterocyclic substituted MONSANTO CO (US) 1989-03-01 — — CN disclosed
EP-0304409-A1 5-Heterocyclic-substituted oxazolidine haloacetamides MONSANTO COMPANY (US) 1989-02-22 — — EP disclosed
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