SCHEMBL6209868

SCHEMBL6209868

CCOC(CCO)CCCCO

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.42
LMNA P02545 4/20 0.40
ALDH1A1 P00352 2/20 0.40
HSD17B10 Q99714 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
TSHR P16473 1/20 0.40
OPRM1 P35372 1/20 0.36
TP53 P04637 1/20 0.33
THRB P10828 1/20 0.32
PTPN1 P18031 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
SCHEMBL10527973 0.93 SMN1; SMN2 (0.52) SMN1; SMN2LMNAALDH1A1HSD17B10MEN1
SCHEMBL7881601 0.88 THRB (0.40) SMN1; SMN2LMNAALDH1A1HSD17B10MEN1
SCHEMBL11587407 0.86 SMN1; SMN2 (0.36) SMN1; SMN2LMNAALDH1A1HSD17B10MEN1
SCHEMBL10582123 0.86 SMN1; SMN2 (0.36) SMN1; SMN2LMNAALDH1A1HSD17B10MEN1
SCHEMBL8346725 0.84 CPB2 (0.38) SMN1; SMN2LMNAALDH1A1HSD17B10MEN1
SCHEMBL7983818 0.82 ALDH1A1 (0.43) SMN1; SMN2LMNAALDH1A1HSD17B10MEN1
SCHEMBL14167487 0.82 ALDH1A1 (0.47) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL11004533 0.81 THRB (0.35) SMN1; SMN2LMNAALDH1A1HSD17B10MEN1
SCHEMBL8658548 0.80 OPRM1 (0.48) LMNATSHROPRM1TP53THRB
SCHEMBL13746215 0.79 NR1I2 (0.33) ALDH1A1HSD17B10TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0725137-B2 KETO GROUP INTRODUCING ENZYME, DNA CODING FOR THE SAME, AND PROCESS FOR PRODUCING KETOCAROTENOID KIRIN BREWERY (JP) 2005-03-02 EP disclosed
EP-0725137-B1 KETO GROUP INTRODUCING ENZYME, DNA CODING FOR THE SAME, AND PROCESS FOR PRODUCING KETOCAROTENOID KIRIN BREWERY (JP) 2002-05-29 EP disclosed
US-6150130-A INTRODUCING DNA STRAND INTO MICROORGANISM CAPABLE OF SYNTHESIZING A BETA-CAROTENE, WHEREIN THE DNA STRAND ENCODES A POLYPEPTIDE CAPABLE OF CONVERTING THE METHYLENE GROUP AT THE 4-POSITION OF A BETA-IONONE RING INTO A KETO GROUP, CULTURING KIRIN BEER KABUSHIKI KAISHA (JP) 2000-11-21 US disclosed
US-5972690-A DNA ENCODING A POLYPEPTIDE HAVING ENZYME ACTIVITY TO CONVERT METHYLENE GROUP AT THE 4-POSITION OF A BETA-IONONE RING INTO A KETO GROUP; FROM AGROBACTERIUM OR ALCALIGENES; TRANSFORMED HOST CELLS FOR PRODUCTION OF ASTAXANTHIN, FOR EXAMPLE KIRIN BEER KABUSHIKI KAISHA (JP) 1999-10-26 US disclosed
US-5910433-A DNA THAT CODES FOR ENZYME WHICH CONVERTS METHYLENE GROUP AT POSITION 4 OF BETA-IONONE RING OF COMPOUND TO A KETO GROUP; FOR EFFICIENT BIOSYNTHESIS OF ORGANIC PIGMENTS FOR FOOD COLORS, AQUACULTURE COLORING, ANTIOXIDANTS KIRIN BEER KABUSHIKI KAISHA (JP) 1999-06-08 US disclosed
US-5811273-A CODING A POLYPEPTIDE HAVING ENZYME ACTIVITY FOR ADDING A HYDROXYL GROUP TO A BETA-IONONE RING KIRIN BEER KABUSHIKI KAISHA (JP) 1998-09-22 US disclosed
EP-0725137-A1 KETO GROUP INTRODUCING ENZYME, DNA CODING FOR THE SAME, AND PROCESS FOR PRODUCING KETOCAROTENOID KIRIN BEER KABUSHIKI KAISHA (JP) 1996-08-07 EP disclosed