SCHEMBL8995827

SCHEMBL8995827

[CH2]/C=C/Cc1ccc(F)cc1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.44
IDO1 P14902 5/20 0.43
AGXT P21549 2/20 0.43
LOXL2 Q9Y4K0 1/20 0.42
TAAR1 Q96RJ0 3/20 0.39
MAOB P27338 2/20 0.39
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PLA2G1B P04054 1/20 0.34
ATG4B Q9Y4P1 1/20 0.34
MIF P14174 1/20 0.34
LMNA P02545 1/20 0.34

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
SCHEMBL8995829 1.00 TRPA1 (0.44) TRPA1IDO1AGXTLOXL2TAAR1
SCHEMBL1046511 0.79 TRPA1 (0.42) TRPA1IDO1AGXTLOXL2TAAR1
SCHEMBL1046510 0.79 TRPA1 (0.42) TRPA1IDO1AGXTLOXL2TAAR1
SCHEMBL9110771 0.77 TAAR1 (0.46) IDO1AGXTLOXL2TAAR1MAOB
SCHEMBL9110764 0.77 TAAR1 (0.46) IDO1AGXTLOXL2TAAR1MAOB
SCHEMBL23182670 0.76 TRPA1 (0.44) TRPA1IDO1AGXTLOXL2TAAR1
SCHEMBL1610310 0.76 TP53 (0.40) IDO1TAAR1MAOBNPC1RAB9A
SCHEMBL8953820 0.76 TRPA1 (0.44) TRPA1IDO1AGXTLOXL2TAAR1
SCHEMBL1455261 0.76 AGXT (0.43) IDO1AGXTTAAR1MAOBRAB9A
SCHEMBL1455258 0.76 AGXT (0.43) IDO1AGXTTAAR1MAOBRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5201936-A Substituted thieno[3,2-b]pyran-5,7-diones BAYER AKTIENGESELLSCHAFT (DE) 1993-04-13 US claimed
EP-0483582-A1 Thieno[3,2-b]pyranones, process for their preparation, intermediates, their use in combatting parasites, their use as herbicides and plantgrowth regulators BAYER AG (DE) 1992-05-06 EP claimed
CN-1134420-A 5-tetrahydropyranone cyclohexenone oxime ethers and their use as herbicides BASF AG (DE) 1996-10-30 CN disclosed
US-5523462-A HERBICIDES; PLANT GROWTH REGULATORS BASF AKTIENGESELLSCHAFT (DE) 1996-06-04 US disclosed
EP-0609259-B1 CYCLOHEXENONE DERIVATES USED AS HERBICIDES BASF AG (DE) 1995-11-22 EP disclosed
US-5389602-A PLANT GROWTH REGULATORS BASF AKTIENGESELLSCHAFT (DE) 1995-02-14 US disclosed
EP-0345635-B1 Herbicidal tetrahydropyran-2,4-diones BASF AG (DE) 1994-10-05 EP disclosed
EP-0422537-B1 Cyclohexenone compounds, process for their preparation and their use as herbicides or plant growth regulators BASF AG (DE) 1994-05-11 EP disclosed
WO-1993008153-A1 CYCLOHEXENONE DERIVATES USED AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1993-04-29 WO disclosed
US-5201935-A Herbicides BASF AKTIENGESELLSCHAFT (DE) 1993-04-13 US disclosed
US-5201936-A Substituted thieno[3,2-b]pyran-5,7-diones BAYER AKTIENGESELLSCHAFT (DE) 1993-04-13 US disclosed
EP-0483582-A1 Thieno[3,2-b]pyranones, process for their preparation, intermediates, their use in combatting parasites, their use as herbicides and plantgrowth regulators BAYER AG (DE) 1992-05-06 EP disclosed
US-5085689-A Preemergence and postemergence treatment BASF AKTIENGESELLSCHAFT (DE) 1992-02-04 US disclosed
US-5034047-A Oxime derivatives of cyclohexenone substituted with nitrogen containing heterocycles BASF AKTIENGESELLSCHAFT (DE) 1991-07-23 US disclosed
EP-0422537-A1 Cyclohexenone compounds, process for their preparation and their use as herbicides or plant growth regulators BASF Aktiengesellschaft (DE) 1991-04-17 EP disclosed
EP-0345635-A1 Herbicidal tetrahydropyran-2,4-diones BASF Aktiengesellschaft (DE) 1989-12-13 EP disclosed