SCHEMBL16959615

SCHEMBL16959615

CCCCOc1cc(Cl)cc([C](C)CO)c1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PLA2G2A P14555 1/20 0.44
▸ RAB9A P51151 2/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ MAPT P10636 1/20 0.41
▸ KMT2A Q03164 1/20 0.40
▸ THRB P10828 1/20 0.38
▸ F2 P00734 3/20 0.38
▸ FAAH O00519 1/20 0.38
▸ LTA4H P09960 1/20 0.38
▸ NR5A1 Q13285 1/20 0.38
▸ GAA P10253 1/20 0.37
▸ TP53 P04637 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ PLA2G4B P0C869 1/20 0.36

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
SCHEMBL16958672 0.87 PLA2G2A (0.46) PLA2G2ARAB9ANPC1SMN1; SMN2HSD17B10
SCHEMBL16960378 0.86 PLA2G2A (0.43) PLA2G2ARAB9ANPC1SMN1; SMN2HSD17B10
SCHEMBL16958988 0.84 PLA2G2A (0.44) PLA2G2ARAB9ALTA4HNR5A1GAA
SCHEMBL16960368 0.83 PLA2G2A (0.43) PLA2G2ARAB9ANPC1SMN1; SMN2HSD17B10
SCHEMBL16960479 0.83 PLA2G2A (0.43) PLA2G2ARAB9ANPC1SMN1; SMN2HSD17B10
SCHEMBL2666319 0.81 PLA2G2A (0.69) PLA2G2AKMT2ATP53TSHRPLA2G4B
SCHEMBL3784498 0.80 MAPT (0.53) PLA2G2ARAB9ANPC1SMN1; SMN2HSD17B10
SCHEMBL8297095 0.80 MAPT (0.59) PLA2G2ARAB9ANPC1SMN1; SMN2HSD17B10
SCHEMBL16953340 0.80 PLA2G2A (0.41) PLA2G2ARAB9ANPC1SMN1; SMN2HSD17B10
SCHEMBL16957061 0.77 MAOB (0.36) SMN1; SMN2MAPTGAAALDH1A1

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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