SCHEMBL649287

SCHEMBL649287

CC(C(=O)O)C(=O)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.55
TDP1 Q9NUW8 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
LMNA P02545 5/20 0.52
SMN1; SMN2 Q16637 4/20 0.52
MAPT P10636 4/20 0.52
NPSR1 Q6W5P4 2/20 0.52
ATM Q13315 2/20 0.52
XBP1 P17861 1/20 0.52
PGR P06401 1/20 0.52
ADRA2A P08913 1/20 0.52
ADRA2B P18089 1/20 0.52
HTR2A P28223 1/20 0.52
HRH1 P35367 1/20 0.52
KCNH2 Q12809 1/20 0.52
CES2 O00748 3/20 0.50
CES1 P23141 3/20 0.50
MDM2 Q00987 1/20 0.47
ALDH1A1 P00352 4/20 0.46
DAO P14920 1/20 0.46

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
SCHEMBL8823334 1.00 KMT2A (0.55) KMT2ATDP1L3MBTL1LMNASMN1; SMN2
Alcohol SCHEMBL28915598 0.92 PGR (0.55) KMT2ATDP1L3MBTL1LMNASMN1; SMN2
SCHEMBL1397470 0.90 KMT2A (0.58) KMT2ATDP1L3MBTL1LMNASMN1; SMN2
SCHEMBL6975810 0.87 SMN1; SMN2 (0.57) KMT2AL3MBTL1LMNASMN1; SMN2MAPT
SCHEMBL3274886 0.86 KMT2A (0.55) KMT2ATDP1L3MBTL1LMNASMN1; SMN2
SCHEMBL20944778 0.86 KMT2A (0.55) KMT2ATDP1L3MBTL1LMNASMN1; SMN2
SCHEMBL28458281 0.84 KMT2A (0.53) KMT2ATDP1L3MBTL1LMNASMN1; SMN2
Levulinic Acid SCHEMBL4826750 0.84 NR4A2 (0.47) KMT2ATDP1L3MBTL1LMNASMN1; SMN2
SCHEMBL6981600 0.82 PARP10 (0.55) SMN1; SMN2MAPTALDH1A1PTGS1NPC1
SCHEMBL6575621 0.82 KMT2A (0.51) KMT2ATDP1L3MBTL1LMNASMN1; SMN2

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 305 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113000341-A Luminous film of living diatom shell doped europium complex and preparation method and application thereof 青岛大学 2021-06-22 CN claimed
WO-2020132792-A1 2-BENZOYL MALONATE COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 江苏联化科技有限公司 2020-07-02 WO claimed
EP-1346977-A1 Method for producing aryl-aminopropanols Bayer Aktiengesellschaft (DE) 2003-09-24 EP claimed
EP-0862551-B1 FLUORO-SUBSTITUTED BENZOYLPROPIONIC ACID DERIVATIVES PHARMACIA & UPJOHN SPA (IT) 2000-05-31 EP claimed
US-5973006-A NERVOUS SYSTEM DISORDERS; ALZHEIMER'S DISEASE; HUNTINGTON DISEASE; PARKINSON'S DISEASE PHARMACIA & UPJOHN S.P.A. (IT) 1999-10-26 US claimed
EP-0584664-B1 Polymerizable dipeptides: preparation, polymerization and use of the polymers for the chromatographic separation of enantiomers BAYER AG (DE) 1998-11-04 EP claimed
EP-0862551-A1 FLUORO-SUBSTITUTED BENZOYLPROPIONIC ACID DERIVATIVES PHARMACIA & UPJOHN S.p.A. (IT) 1998-09-09 EP claimed
WO-1997015550-A1 FLUORO-SUBSTITUTED BENZOYLPROPIONIC ACID DERIVATIVES PHARMACIA & UPJOHN S.P.A. (IT) 1997-05-01 WO claimed
CN-1072863-A Be used to improve the dermal osmosis system of the reinforcement of medicine localized delivery RICHARDSON VICKS INC (US) 1993-06-09 CN claimed
US-5082588-A Hygrometers ELLIOTT STANLEY B (US) 1992-01-21 US claimed
EP-0164101-B1 BENZOYLPROPIONIC ACID DERIVATIVES, THEIR USE AND PHARMACEUTICAL COMPOSITIONS TAISHO PHARMACEUTICAL CO. LTD (JP) 1988-09-07 EP claimed
US-4600540-A &MMUNOLOGY, ANTIARTHRITIC, ANTICARCINOGENIC, BACTERICIDES, ASTHMA TAISHO PHARMACEUTICAL CO., LTD. (JP) 1986-07-15 US claimed
EP-0164101-A2 Benzoylpropionic acid derivatives, their use and pharmaceutical compositions TAISHO PHARMACEUTICAL CO. LTD (JP) 1985-12-11 EP claimed
JP-56103170-A None JP disclosed
JP-4069336-A None JP disclosed
JP-9227505-A None JP disclosed
US-4017517-A SPASMOLYTIC, CHOLERETIC TAKEDA CHEMICAL INDUSTRIES, LTD. (JA) 1977-04-12 US disclosed
US-4001312-A AMINOALCOHOLS SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1977-01-04 US disclosed
US-3943169-A DIURETIC, SPASMOLYTIC TAKEDA CHEMICAL INDUSTRIES, LTD (JA) 1976-03-09 US disclosed
JP-S05515460-A 0001-01-01 JP disclosed