SCHEMBL16961356

SCHEMBL16961356

CSc1cccc([C](C)CO)c1Cl

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 6/20 0.36
▸ MAPT P10636 4/20 0.36
▸ MEN1 O00255 3/20 0.36
▸ GAA P10253 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ LMNA P02545 3/20 0.33
▸ HTT P42858 2/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ HPGD P15428 4/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ NPC1 O15118 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32

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
SCHEMBL16958247 0.81 KMT2A (0.40) KMT2AMAPTMEN1GAAALDH1A1
SCHEMBL16961211 0.79 KMT2A (0.34) KMT2AMAPTMEN1GAAALDH1A1
SCHEMBL16952094 0.79 LMNA (0.37) KMT2AMAPTMEN1GAAALDH1A1
SCHEMBL16956070 0.77 MAPT (0.37) KMT2AMAPTMEN1GAAALDH1A1
SCHEMBL16956072 0.77 TSHR (0.50) KMT2AMAPTMEN1ALDH1A1MAPK1
SCHEMBL16953376 0.76 TSHR (0.45) KMT2AMEN1ALDH1A1LMNAMAPK1
SCHEMBL16951879 0.76 P2RX7 (0.38) KMT2AMAPTMEN1ALDH1A1HTT
SCHEMBL16961299 0.75 ALDH1A1 (0.35) KMT2AMAPTMEN1GAAALDH1A1
SCHEMBL16955650 0.74 CYP11B1 (0.40) KMT2AMEN1GAAALDH1A1
SCHEMBL16951855 0.74 TSHR (0.31) —

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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