SCHEMBL16950353

SCHEMBL16950353

CCc1c([C](C)C)cccc1C(=O)OC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.47
▸ TSHR P16473 1/20 0.47
▸ ALDH1A1 P00352 5/20 0.46
▸ HSD17B10 Q99714 3/20 0.46
▸ CFTR P13569 1/20 0.46
▸ KMT2A Q03164 1/20 0.45
▸ KDM4E B2RXH2 3/20 0.44
▸ POLB P06746 2/20 0.44
▸ ATM Q13315 1/20 0.44
▸ GAA P10253 1/20 0.44
▸ GLA P06280 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ CA1 P00915 2/20 0.41
▸ CA2 P00918 2/20 0.41
▸ CA9 Q16790 2/20 0.41
▸ CA12 O43570 1/20 0.41
▸ CA7 P43166 1/20 0.41
▸ CA14 Q9ULX7 1/20 0.41
▸ CA5A P35218 1/20 0.41
▸ MAPT P10636 1/20 0.41

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
SCHEMBL22481057 0.93 LMNA (0.53) LMNATSHRALDH1A1HSD17B10CFTR
SCHEMBL26162755 0.89 LMNA (0.47) LMNATSHRALDH1A1HSD17B10CFTR
SCHEMBL28680548 0.85 ALDH1A1 (0.53) LMNATSHRALDH1A1HSD17B10CFTR
SCHEMBL2655486 0.82 LMNA (0.61) LMNATSHRALDH1A1HSD17B10CFTR
SCHEMBL7870569 0.82 ALDH1A1 (0.48) LMNATSHRALDH1A1HSD17B10CFTR
SCHEMBL16950934 0.81 LMNA (0.46) LMNATSHRALDH1A1HSD17B10CFTR
SCHEMBL4739763 0.81 ALDH1A1 (0.47) LMNATSHRALDH1A1HSD17B10CFTR
SCHEMBL16952642 0.81 ALDH1A1 (0.49) LMNATSHRALDH1A1HSD17B10CFTR
SCHEMBL6828757 0.81 GAA (0.50) LMNATSHRALDH1A1HSD17B10CFTR
SCHEMBL8127577 0.81 LMNA (0.46) LMNATSHRALDH1A1HSD17B10CFTR

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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