SCHEMBL16958471

SCHEMBL16958471

C=C[C](C)c1cc(F)cc(OCCCC)c1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PLA2G2A P14555 1/20 0.41
▸ KAT6A Q92794 2/20 0.39
▸ FAAH O00519 1/20 0.35
▸ LTA4H P09960 1/20 0.35
▸ NR5A1 Q13285 1/20 0.35
▸ TSHR P16473 2/20 0.35
▸ GAA P10253 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ TP53 P04637 1/20 0.35
▸ PLA2G4B P0C869 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
SCHEMBL16954109 0.86 KAT6A (0.41) KAT6ARAB9A
SCHEMBL16962105 0.85 KAT6A (0.34) KAT6A
SCHEMBL16960574 0.85 PLA2G2A (0.46) PLA2G2ALTA4HNR5A1TSHRGAA
SCHEMBL16956747 0.84 AHR (0.50) PLA2G2ATSHRRAB9A
SCHEMBL16951121 0.84 PLA2G2A (0.42) PLA2G2ALTA4HNR5A1TSHRGAA
SCHEMBL16952189 0.84 PLA2G2A (0.42) PLA2G2ALTA4HNR5A1TSHRGAA
SCHEMBL16958183 0.83 PLA2G2A (0.46) PLA2G2AKAT6AFAAHLTA4HNR5A1
SCHEMBL16953340 0.82 PLA2G2A (0.41) PLA2G2AFAAHLTA4HNR5A1TSHR
SCHEMBL16954357 0.82 PLA2G2A (0.41) PLA2G2ALTA4HNR5A1TSHRGAA
SCHEMBL16955003 0.82 PLA2G2A (0.41) PLA2G2ALTA4HNR5A1TSHRGAA

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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