SCHEMBL16957236

SCHEMBL16957236

CCOc1cccc(C)c1C(F)(F)F

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 9/20 0.45
▸ HPGD P15428 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.41
▸ PDK2 Q15119 1/20 0.41
▸ GRM5 P41594 1/20 0.40
▸ MEN1 O00255 3/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ MAPT P10636 6/20 0.39
▸ TDP1 Q9NUW8 3/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ GRK6 P43250 2/20 0.39
▸ PABPC1 P11940 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ LMNA P02545 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ RECQL P46063 1/20 0.38
▸ KCNK3 O14649 1/20 0.38

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
SCHEMBL18723280 0.88 L3MBTL1 (0.50) L3MBTL1HPGDALDH1A1PDK2GRM5
SCHEMBL16957716 0.86 L3MBTL1 (0.40) L3MBTL1ALDH1A1GRM5MEN1KMT2A
SCHEMBL22043309 0.83 ALDH1A1 (0.42) L3MBTL1ALDH1A1MEN1KMT2AMAPT
SCHEMBL16957233 0.80 L3MBTL1 (0.44) L3MBTL1HPGDALDH1A1PDK2GRM5
SCHEMBL18374891 0.80 CYP1A2 (0.44) L3MBTL1HPGDALDH1A1PDK2GRM5
SCHEMBL16952213 0.79 CA1 (0.42) HPGDALDH1A1PDK2MEN1KMT2A
SCHEMBL17897034 0.78 L3MBTL1 (0.50) L3MBTL1HPGDALDH1A1TDP1KDM4E
SCHEMBL18364498 0.78 CYP1A2 (0.38) L3MBTL1HPGDALDH1A1MAPTKDM4E
SCHEMBL16955194 0.77 L3MBTL1 (0.42) L3MBTL1HPGDALDH1A1PDK2GRM5
SCHEMBL16951436 0.77 KCNK3 (0.44) L3MBTL1HPGDALDH1A1PDK2GRM5

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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