SCHEMBL3781252

SCHEMBL3781252

CCCCCCCC(C)OC(=O)c1cccc(C(=O)OC(C)CCCCCCC)c1

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.62
KDM4E B2RXH2 1/20 0.51
KMT2A Q03164 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
MAPT P10636 1/20 0.47
FAAH O00519 5/20 0.47
CNR1 P21554 1/20 0.46
CNR2 P34972 1/20 0.46
PNLIP P16233 1/20 0.45

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
SCHEMBL27899853 0.94 ALDH1A1 (0.56) ALDH1A1KDM4EKMT2AL3MBTL1MAPT
SCHEMBL1417774 0.94 ALDH1A1 (0.64) ALDH1A1KDM4EKMT2AL3MBTL1MAPT
SCHEMBL1142463 0.89 ALDH1A1 (0.72) ALDH1A1KDM4EKMT2AL3MBTL1FAAH
SCHEMBL26775029 0.89 ALDH1A1 (0.72) ALDH1A1KDM4EKMT2AL3MBTL1FAAH
SCHEMBL12083567 0.89 ALDH1A1 (0.72) ALDH1A1KDM4EKMT2AL3MBTL1FAAH
SCHEMBL2362569 0.89 ALDH1A1 (0.72) ALDH1A1KDM4EKMT2AL3MBTL1FAAH
SCHEMBL27262020 0.89 ALDH1A1 (0.72) ALDH1A1KDM4EKMT2AL3MBTL1FAAH
SCHEMBL1142467 0.89 ALDH1A1 (0.72) ALDH1A1KDM4EKMT2AL3MBTL1FAAH
SCHEMBL8457661 0.89 PNLIP (0.58) ALDH1A1KDM4EKMT2AL3MBTL1MAPT
SCHEMBL6546118 0.88 ALDH1A1 (0.69) ALDH1A1KDM4EKMT2AL3MBTL1FAAH

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140228135-A1 GREASE COMPOSITION FOR CONSTANT VELOCITY JOINT AND CONSTANT VELOCITY JOINT KYODO YUSHI CO., LTD. (JP) 2014-08-14 US disclosed
US-20100323934-A1 GREASE COMPOSITION FOR CONSTANT VELOCITY JOINT AND CONSTANT VELOCITY JOINT NTN CORPORATION (JP) 2010-12-23 US disclosed