SCHEMBL16954783

SCHEMBL16954783

CCOc1c(Br)cccc1[C](C)CF

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.36
▸ F2R P25116 1/20 0.35
▸ LMNA P02545 3/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ GAA P10253 2/20 0.34
▸ THRB P10828 1/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ MAPT P10636 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ TSHR P16473 2/20 0.33
▸ KAT6A Q92794 1/20 0.32
▸ HTT P42858 2/20 0.32
▸ HPGD P15428 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ ATM Q13315 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ DHODH Q02127 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ POLB P06746 1/20 0.31

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
SCHEMBL16952648 0.85 THRB (0.35) ALDH1A1F2RLMNASMN1; SMN2THRB
SCHEMBL16953918 0.83 L3MBTL1 (0.38) ALDH1A1LMNASMN1; SMN2GAAKMT2A
SCHEMBL16960803 0.83 THRB (0.38) ALDH1A1F2RLMNASMN1; SMN2THRB
SCHEMBL16958505 0.82 ALDH1A1 (0.39) ALDH1A1LMNASMN1; SMN2GAAKMT2A
SCHEMBL16959311 0.82 HCRTR1 (0.41) ALDH1A1LMNAGAAKMT2AMAPT
SCHEMBL16956756 0.81 LMNA (0.33) ALDH1A1LMNASMN1; SMN2GAAKMT2A
SCHEMBL16953320 0.81 GABRA1 (0.37) ALDH1A1LMNASMN1; SMN2GAAKMT2A
SCHEMBL16950579 0.81 ALDH1A1 (0.41) ALDH1A1LMNASMN1; SMN2GAAKMT2A
SCHEMBL16955894 0.78 ELANE (0.35) ALDH1A1LMNAKMT2ATSHRATM
SCHEMBL16952216 0.77 HPGD (0.40) ALDH1A1LMNASMN1; SMN2GAAKMT2A

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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