SCHEMBL16956756

SCHEMBL16956756

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

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ TSHR P16473 1/20 0.33
▸ BPTF Q12830 1/20 0.33
▸ ALDH1A1 P00352 3/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ L3MBTL1 Q9Y468 3/20 0.32
▸ TP53 P04637 2/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ MRGPRX4 Q96LA9 1/20 0.32
▸ KMT2A Q03164 3/20 0.32
▸ ATM Q13315 1/20 0.32
▸ SMN1; SMN2 Q16637 3/20 0.32
▸ GAA P10253 2/20 0.32
▸ TDP1 Q9NUW8 2/20 0.32
▸ MEN1 O00255 2/20 0.32
▸ RAB9A P51151 2/20 0.32
▸ POLB P06746 2/20 0.32
▸ ABL1 P00519 1/20 0.32
▸ MAPT P10636 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
SCHEMBL16957084 0.85 BPTF (0.34) LMNAKDM4ETSHRBPTFALDH1A1
SCHEMBL16953918 0.83 L3MBTL1 (0.38) LMNAKDM4ETSHRALDH1A1L3MBTL1
SCHEMBL16958186 0.83 KMT2A (0.33) LMNAALDH1A1HSD17B10L3MBTL1KMT2A
SCHEMBL16953848 0.83 BPTF (0.36) LMNAKDM4ETSHRBPTFALDH1A1
SCHEMBL16958505 0.82 ALDH1A1 (0.39) LMNAKDM4ETSHRALDH1A1HSD17B10
SCHEMBL16959311 0.82 HCRTR1 (0.41) LMNAALDH1A1HSD17B10L3MBTL1KMT2A
SCHEMBL16953320 0.81 GABRA1 (0.37) LMNAKDM4ETSHRALDH1A1L3MBTL1
SCHEMBL16950579 0.81 ALDH1A1 (0.41) LMNAKDM4EALDH1A1L3MBTL1MRGPRX4
SCHEMBL16954783 0.81 ALDH1A1 (0.36) LMNAKDM4ETSHRALDH1A1HSD17B10
SCHEMBL16955894 0.78 ELANE (0.35) LMNAKDM4ETSHRALDH1A1L3MBTL1

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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