SCHEMBL6773057

SCHEMBL6773057

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

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.40
HPGD P15428 3/20 0.39
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
POLB P06746 3/20 0.34
EPHX2 P34913 1/20 0.33
NPC1 O15118 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
SCHEMBL6772422 0.90 ALDH1A1 (0.43) ALDH1A1HPGDLMNASMN1; SMN2KMT2A
SCHEMBL6767409 0.82 ALDH1A1 (0.36) ALDH1A1HPGDLMNASMN1; SMN2POLB
SCHEMBL6771811 0.78 LMNA (0.35) ALDH1A1HPGDLMNASMN1; SMN2KMT2A
SCHEMBL6770879 0.78 ALDH1A1 (0.34) ALDH1A1HPGDLMNASMN1; SMN2KMT2A
SCHEMBL32688617 0.78 ALDH1A1 (0.48) ALDH1A1HPGDLMNASMN1; SMN2KMT2A
SCHEMBL6767406 0.75 ALDH1A1 (0.34) ALDH1A1HPGDLMNASMN1; SMN2POLB
SCHEMBL9908422 0.74 HPGD (0.46) ALDH1A1HPGDLMNASMN1; SMN2KMT2A
SCHEMBL2994979 0.74 ALDH1A1 (0.44) ALDH1A1HPGDLMNASMN1; SMN2KMT2A
SCHEMBL11296271 0.72 HPGD (0.42) ALDH1A1HPGDLMNASMN1; SMN2KMT2A
SCHEMBL6771305 0.71 ALDH1A1 (0.39) ALDH1A1HPGDLMNASMN1; SMN2POLB

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 3 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
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 disclosed