SCHEMBL16954738

SCHEMBL16954738

[CH2]C(C=C)c1cc(F)ccc1CC

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.32
▸ PKM P14618 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ RIPK1 Q13546 2/20 0.31
▸ IDO1 P14902 2/20 0.31
▸ AGXT P21549 2/20 0.31
▸ PSEN1 P49768 1/20 0.30
▸ PSEN2 P49810 1/20 0.30
▸ APH1B Q8WW43 1/20 0.30
▸ NCSTN Q92542 1/20 0.30
▸ APH1A Q96BI3 1/20 0.30
▸ PSENEN Q9NZ42 1/20 0.30
▸ MPO P05164 1/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ TP53 P04637 1/20 0.30
▸ ALOX15 P16050 1/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ HTT P42858 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30

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
SCHEMBL16953503 0.86 F2RL1 (0.38) MAPTMPOLMNA
SCHEMBL16950445 0.81 PSEN1 (0.35) MAPTPKMSMN1; SMN2RIPK1IDO1
SCHEMBL16951609 0.80 SRC (0.34) MAPTSMN1; SMN2KDM4ELMNATP53
SCHEMBL16958707 0.80 ALDH1A1 (0.38) MAPTSMN1; SMN2LMNAMAPK1
SCHEMBL16958927 0.79 GAA (0.35) IDO1PSEN1PSEN2APH1BNCSTN
SCHEMBL16952684 0.79 GABRA1 (0.32) MAPTSMN1; SMN2LMNAHTTHSD17B10
SCHEMBL16961288 0.79 MAPT (0.32) MAPTPKMSMN1; SMN2RIPK1IDO1
SCHEMBL16956628 0.78 PDE2A (0.40) MAPTIDO1LMNA
SCHEMBL16955596 0.77 PSEN1 (0.37) MAPTPKMSMN1; SMN2RIPK1PSEN1
SCHEMBL21725483 0.77 FFAR1 (0.37) MAPTPKMSMN1; SMN2RIPK1IDO1

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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