SCHEMBL10458909

SCHEMBL10458909

CC(C)Oc1cc(NC(=O)CCl)ccc1Cl

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ RORC P51449 2/20 0.56
▸ GSTO1 P78417 9/20 0.55
▸ CYP3A4 P08684 1/20 0.48
▸ MEN1 O00255 3/20 0.46
▸ KMT2A Q03164 3/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ LMNA P02545 4/20 0.45
▸ MAPT P10636 2/20 0.45
▸ NPSR1 Q6W5P4 2/20 0.45
▸ HTT P42858 2/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ TSHR P16473 1/20 0.45
▸ GAA P10253 1/20 0.44

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
SCHEMBL5796044 0.84 GRM4 (0.57) GSTO1CYP3A4MEN1KMT2AALDH1A1
SCHEMBL30623235 0.84 RORC (0.78) RORCALDH1A1MAPTSMN1; SMN2
SCHEMBL17603152 0.84 RORC (0.78) RORCALDH1A1MAPTSMN1; SMN2
SCHEMBL1948433 0.77 ALDH1A1 (0.64) MEN1KMT2AALDH1A1LMNAMAPT
SCHEMBL7326435 0.77 RORC (0.52) RORCMEN1KMT2AALDH1A1LMNA
SCHEMBL10654061 0.77 ALDH1A1 (0.67) ALDH1A1HTTSMN1; SMN2
SCHEMBL29678387 0.77 ALDH1A1 (0.67) ALDH1A1HTTSMN1; SMN2
SCHEMBL30833308 0.76 CYP3A4 (0.71) GSTO1CYP3A4MEN1KMT2AALDH1A1
SCHEMBL4003878 0.76 CYP3A4 (0.71) GSTO1CYP3A4MEN1KMT2AALDH1A1
SCHEMBL7081917 0.75 NPC1 (0.61) GSTO1CYP3A4KMT2AALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4906286-A Herbicidal 2-aryl-1,2,4-triazine-3,5(2H,4H)-diones and sulfur analogs thereof FMC CORPORATION (US) 1990-03-06 — — US disclosed
EP-0185731-A4 HERBICIDAL 2-ARYL-1,2,4-TRIAZINE-3,5(2H,4H)-DIONES AND SULFUR ANALOGS THEREOF. FMC CORP (US) 1988-11-02 — — EP disclosed
US-4766233-A Herbicidal 2-aryl-1,2,4-triazine-3,5(2H,4H)-diones and sulfur analogs thereof FMC CORPORATION (US) 1988-08-23 — — US disclosed
CN-85105721-A Weedicide 2-aryl-1,2, and 4-triazine-3,5 (2H, 4H)-diketone and sulfur containing analogs thereof — 1987-09-02 — — CN disclosed
EP-0185731-A1 HERBICIDAL 2-ARYL-1,2,4-TRIAZINE-3,5(2H,4H)-DIONES AND SULFUR ANALOGS THEREOF FMC Corporation (US) 1986-07-02 — — EP disclosed
WO-1986000072-A1 HERBICIDAL 2-ARYL-1,2,4-TRIAZINE-3,5(2H,4H)-DIONES AND SULFUR ANALOGS THEREOF FMC CORPORATION (US) 1986-01-03 — — WO disclosed
Send feedback