SCHEMBL6771819

SCHEMBL6771819

CCC(CC)(C(=O)OC(C1CC2CCC1CC2)C1CC2CCC1CC2)C(=O)OC(C1CC2CCC1CC2)C1CC2CCC1CC2

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
EPHX2 P34913 1/20 0.31
LMNA P02545 1/20 0.31
HPGD P15428 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL6771818 0.93 ALDH1A1 (0.31) ALDH1A1
SCHEMBL6778129 0.92 ALDH1A1 (0.40) ALDH1A1EPHX2LMNAHPGDSMN1; SMN2
SCHEMBL6770879 0.86 ALDH1A1 (0.34) ALDH1A1EPHX2LMNAHPGDSMN1; SMN2
SCHEMBL6778123 0.85 ALDH1A1 (0.38) ALDH1A1EPHX2LMNAHPGDSMN1; SMN2
SCHEMBL6767561 0.82 LMNA (0.33) LMNAHPGDSMN1; SMN2
SCHEMBL6767559 0.78 LMNA (0.31) LMNAHPGDSMN1; SMN2
SCHEMBL6771305 0.75 ALDH1A1 (0.39) ALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL6767409 0.75 ALDH1A1 (0.36) ALDH1A1EPHX2LMNAHPGDSMN1; SMN2
SCHEMBL6766423 0.74 HPGD (0.41) ALDH1A1EPHX2LMNAHPGDSMN1; SMN2
SCHEMBL6771938 0.74

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-6797680-B2 NON-TOXIC TO HUMANS AND POSSES A NON- OFFENSIVE ODOR, WHILE ALSO BEING INEXPENSIVE TO MANUFACTURE GENERAL MOTORS CORPORATION 2004-09-28 US claimed
US-20040152607-A1 TRACTION FLUID WITH DI-ACID ESTER BRIDGED DIMER GM Global Technology Operations LLC 2004-08-05 US claimed