SCHEMBL11639734

SCHEMBL11639734

CCC(C)(O)CCCCCCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 7/20 0.46
MAPT P10636 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
FDPS P14324 3/20 0.44
LTB4R Q15722 1/20 0.44
FAAH O00519 3/20 0.44
CES1 P23141 3/20 0.44
KCNH2 Q12809 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
POLB P06746 1/20 0.42

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
SCHEMBL11638625 1.00 SIGMAR1 (0.46) SIGMAR1MAPTRXFP1FDPSLTB4R
SCHEMBL4557580 0.98 FDPS (0.46) SIGMAR1MAPTRXFP1FDPSLTB4R
SCHEMBL27782631 0.93 POLB (0.45) SIGMAR1FDPSKCNH2L3MBTL1POLB
SCHEMBL114480 0.85 TDP1 (0.43) MAPTFDPSPOLB
SCHEMBL11864517 0.84 SIGMAR1 (0.44) SIGMAR1MAPTRXFP1FDPSLTB4R
SCHEMBL11640727 0.84 IGF1R (0.46)
SCHEMBL11637834 0.84 IGF1R (0.46)
SCHEMBL11639315 0.83 TNNC1 (0.41) FAAH
SCHEMBL11641629 0.83 TNNC1 (0.41) POLB
SCHEMBL11635584 0.83 KCNH2 (0.46) FDPSKCNH2L3MBTL1

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-4125541-A Aryl substituted ketones STERLING DRUG INC. (US) 1978-11-14 US disclosed
US-4125714-A Aryl substituted cycloalkanones STERLING DRUG INC. (US) 1978-11-14 US disclosed