SCHEMBL16951265

SCHEMBL16951265

C=Cc1cccc(OCCC)c1C(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ MCHR1 Q99705 1/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ CYP2A6 P11509 1/20 0.35
▸ HPGD P15428 3/20 0.35
▸ ALDH1A1 P00352 3/20 0.35
▸ HTT P42858 2/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ CHRM2 P08172 2/20 0.34
▸ LMNA P02545 2/20 0.34
▸ TSHR P16473 2/20 0.34
▸ CHRM1 P11229 1/20 0.34
▸ ALOX15 P16050 1/20 0.34
▸ ACHE P22303 1/20 0.34
▸ KCNH2 Q12809 1/20 0.34
▸ HIF1A Q16665 1/20 0.34
▸ HTR2C P28335 1/20 0.34
▸ HTR2B P41595 1/20 0.34
▸ AR P10275 1/20 0.33

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
SCHEMBL16957466 0.88 L3MBTL1 (0.41) L3MBTL1KMT2AMEN1HPGDALDH1A1
SCHEMBL16955784 0.85 L3MBTL1 (0.37) L3MBTL1MCHR1KMT2AMEN1CYP2A6
SCHEMBL2098846 0.80 HPGD (0.48) L3MBTL1MCHR1KMT2AMEN1CYP2A6
SCHEMBL16953474 0.80 MCHR1 (0.39) L3MBTL1MCHR1KMT2AMEN1CYP2A6
SCHEMBL16957713 0.80 L3MBTL1 (0.39) L3MBTL1MCHR1KMT2AMEN1CYP2A6
SCHEMBL16959757 0.79 CHRM2 (0.39) L3MBTL1MCHR1KMT2AMEN1CYP2A6
SCHEMBL16952382 0.79 NFE2L2 (0.44) KMT2AMEN1ALDH1A1SMN1; SMN2TSHR
SCHEMBL16954680 0.79 MCHR1 (0.41) L3MBTL1MCHR1KMT2AMEN1CYP2A6
SCHEMBL9310453 0.78 CHRM2 (0.49) L3MBTL1MCHR1KMT2AMEN1CYP2A6
SCHEMBL16958262 0.78 HTR1B (0.40) L3MBTL1MCHR1KMT2AMEN1CYP2A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2900645-A1 3-PHENYLISOXAZOLIN DERIVATIVES WITH HERBICIDAL ACTION Bayer CropScience AG (DE) 2015-08-05 — — EP disclosed
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