SCHEMBL27633586

SCHEMBL27633586

O=C(O)COC(=O)c1ccccc1C(=O)OCC(=O)O

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.59
ALDH1A1 P00352 5/20 0.55
CYP3A4 P08684 2/20 0.53
NPC1 O15118 1/20 0.53
PAM P19021 1/20 0.53
TDP1 Q9NUW8 2/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
TP53 P04637 1/20 0.50
MAPK1 P28482 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
ALOX15 P16050 1/20 0.50
LMNA P02545 1/20 0.48
HTT P42858 1/20 0.47

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
SCHEMBL11763788 0.98 TSHR (0.57) TSHRALDH1A1CYP3A4NPC1PAM
SCHEMBL11662013 0.92 ALDH1A1 (0.62) TSHRALDH1A1CYP3A4NPC1PAM
SCHEMBL27984331 0.90 TSHR (0.78) TSHRALDH1A1CYP3A4TDP1L3MBTL1
SCHEMBL11662007 0.89 CYP3A4 (0.49) TSHRALDH1A1CYP3A4NPC1PAM
SCHEMBL28033393 0.89 ALDH1A1 (0.62) TSHRALDH1A1CYP3A4L3MBTL1LMNA
SCHEMBL554491 0.88 TDP1 (0.66) TSHRALDH1A1NPC1TDP1L3MBTL1
SCHEMBL30114967 0.88 TDP1 (0.66) TSHRALDH1A1NPC1TDP1L3MBTL1
SCHEMBL28854265 0.86 MEN1 (0.65) TSHRALDH1A1NPC1TDP1L3MBTL1
Ethylene Glycol SCHEMBL28033955 0.84 ALDH1A1 (0.58) TSHRALDH1A1CYP3A4L3MBTL1LMNA
SCHEMBL582352 0.82 TDP1 (0.63) TSHRALDH1A1NPC1PAMTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101410098-B Microspheres comprising nanocapsules containing lipophilic drugs YISSUM RES DEV CO 2012-01-18 CN claimed
CN-101410098-A Microspheres comprising nanocapsules containing lipophilic drugs YISSUM RES DEV CO (IL) 2009-04-15 CN claimed
CN-1874795-A Method for coating implants by way of a printing method BLUE MEMBRANES GMBH (DE) 2006-12-06 CN claimed
CN-1829667-A Method for the production of porous carbon-based molded bodies, and use thereof as cell culture carrier systems and culture systems BLUE MEMBRANES GMBH (DE) 2006-09-06 CN claimed
CN-101410098-B Microspheres comprising nanocapsules containing lipophilic drugs YISSUM RES DEV CO 2012-01-18 CN disclosed
CN-1829667-B Method for the production of porous carbon-based molded bodies, and use thereof as cell culture carrier systems and culture systems CINV AG 2010-04-07 CN disclosed
CN-101652467-A The high surface cultivation system that contains filler CINV AG DE 2010-02-17 CN disclosed
CN-101646764-A High surface cultivation system CINV AG DE 2010-02-10 CN disclosed
CN-101410098-A Microspheres comprising nanocapsules containing lipophilic drugs YISSUM RES DEV CO (IL) 2009-04-15 CN disclosed
CN-101238166-A Process for production of porous reticulated composite materials CINV AG (DE) 2008-08-06 CN disclosed
CN-100406070-C Method and device for coating implants by means of printing and coated implants produced by said method BLUE MEMBRANES GMBH (DE) 2008-07-30 CN disclosed
CN-101142149-A Process for the preparation of porous sintered metal materials CINV AG (DE) 2008-03-12 CN disclosed
CN-101098916-A Composite materials containing carbon nanoparticles BLUE MEMBRANES GMBH (DE) 2008-01-02 CN disclosed
CN-1874795-A Method for coating implants by way of a printing method BLUE MEMBRANES GMBH (DE) 2006-12-06 CN disclosed
CN-1829667-A Method for the production of porous carbon-based molded bodies, and use thereof as cell culture carrier systems and culture systems BLUE MEMBRANES GMBH (DE) 2006-09-06 CN disclosed