SCHEMBL9508048

SCHEMBL9508048

CCCCCCCCCOC(=O)C(C)CCC(C)O

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.48
MAPT P10636 1/20 0.46
EPHX1 P07099 1/20 0.46
TSHR P16473 3/20 0.44
ACE2 Q9BYF1 1/20 0.44
HCAR2 Q8TDS4 1/20 0.42
RAD52 P43351 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
FAAH O00519 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
FFAR4 Q5NUL3 1/20 0.41
ACHE P22303 1/20 0.41

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
SCHEMBL9511078 1.00 NAAA (0.48) NAAAMAPTEPHX1TSHRACE2
SCHEMBL9509884 1.00 NAAA (0.48) NAAAMAPTEPHX1TSHRACE2
SCHEMBL9509864 1.00 NAAA (0.48) NAAAMAPTEPHX1TSHRACE2
SCHEMBL9507698 1.00 NAAA (0.48) NAAAMAPTEPHX1TSHRACE2
SCHEMBL9507380 0.98 NAAA (0.46) NAAAMAPTEPHX1TSHRACE2
SCHEMBL9507791 0.93 ALDH1A1 (0.47) NAAAMAPTTSHRACE2HCAR2
SCHEMBL7223667 0.87 CA1 (0.53) NAAAMAPTEPHX1TSHRACE2
SCHEMBL7223773 0.87 CA1 (0.53) NAAAMAPTEPHX1TSHRACE2
SCHEMBL7223421 0.87 NAAA (0.53) NAAAEPHX1TSHRACE2HCAR2
SCHEMBL7223700 0.87 CA1 (0.53) NAAAMAPTEPHX1TSHRACE2

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
EP-0388960-B1 OPTICALLY ACTIVE COMPOUNDS AND THEIR PREPARATION AND USE HITACHI, LTD. (JP) 1993-10-06 EP disclosed
US-5152919-A Stability, chemical resistance, high speed response, large spo ntaneous polarization, molecular orientation and wide temperat ure range HITACHI, LTD. (JP) 1992-10-06 US disclosed
EP-0388960-A1 Optically active compounds and their preparation and use HITACHI, LTD. (JP) 1990-09-26 EP disclosed