SCHEMBL7507705

SCHEMBL7507705

CCCCOC=CCC(F)(F)F

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 1/20 0.31
ADRB1 P08588 1/20 0.31
ADRB3 P13945 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
SCHEMBL7507703 1.00 ADRB2 (0.31) ADRB2ADRB1ADRB3
SCHEMBL7507226 0.78
SCHEMBL7508829 0.78
SCHEMBL12197478 0.75
SCHEMBL6058346 0.75
SCHEMBL723502 0.75
SCHEMBL8724680 0.74 ADRB2 (0.45) ADRB2ADRB1ADRB3
SCHEMBL8724684 0.74 ADRB2 (0.45) ADRB2ADRB1ADRB3
SCHEMBL16863887 0.73 LPAR3 (0.38) ADRB2ADRB1ADRB3
SCHEMBL28146382 0.73 ADRB2 (0.36) ADRB2ADRB1ADRB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113292487-B Preparation method of pyroxsulam intermediate 江苏省农用激素工程技术研究中心有限公司 2022-04-08 CN disclosed
EP-1242427-A1 NOVEL PIPERIDINE AND PIPERAZINE DERIVATIVES AstraZeneca AB (SE) 2002-09-25 EP disclosed
EP-0744400-B1 Process for producing 4-trifluoromethylnicotinic acid ISHIHARA SANGYO KAISHA (JP) 2002-09-11 EP disclosed
WO-2001046200-A1 NOVEL PIPERIDINE AND PIPERAZINE DERIVATIVES ASTRAZENECA AB (SE) 2001-06-28 WO disclosed