SCHEMBL7723978

SCHEMBL7723978

CC(C)(C)OC(C)(OC(=O)C1C2C=CC(C2)C1C(=O)OC(C)(OC(C)(C)C)OC(C)(C)C)OC(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
POLB P06746 1/20 0.37
HTT P42858 1/20 0.35
LMNA P02545 1/20 0.33
KDM4E B2RXH2 1/20 0.30

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
SCHEMBL1409756 0.85 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2POLBHTTLMNA
SCHEMBL5838085 0.79 ALDH1A1 (0.37) ALDH1A1SMN1; SMN2POLBHTTLMNA
SCHEMBL5837416 0.79 POLB (0.51) ALDH1A1SMN1; SMN2POLBLMNAKDM4E
SCHEMBL5838089 0.79 ALDH1A1 (0.37) ALDH1A1SMN1; SMN2POLBHTTLMNA
SCHEMBL3150000 0.79 POLB (0.51) ALDH1A1SMN1; SMN2POLBLMNAKDM4E
SCHEMBL3292755 0.76 ALDH1A1 (0.38) ALDH1A1SMN1; SMN2POLBHTTLMNA
SCHEMBL686094 0.75 MAPK1 (0.38) ALDH1A1SMN1; SMN2POLBHTTLMNA
SCHEMBL18906481 0.74 MAPK1 (0.37) ALDH1A1SMN1; SMN2POLBHTT
SCHEMBL13898963 0.74 MAPK1 (0.37) ALDH1A1SMN1; SMN2POLBHTT
SCHEMBL7156320 0.73 ALDH1A1 (0.34) ALDH1A1SMN1; SMN2POLBHTTLMNA

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
US-6391518-B1 COPOLYMER OF 5-NORBORNENE-2,3-DICARBOXYLIC ACID AND 5-NORBORNENE-2-CARBOXYLATE DERIVATIVES; SEMICONDUCTORS, PHOTOLITHOGRAPHY HYUNDAI ELECTRONICS INDUSTRIES CO., LTD. (KR) 2002-05-21 US disclosed