SCHEMBL7654599

SCHEMBL7654599

O=C(O)CCC(O)(CC(=O)O)CC(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.43
HMGCR P04035 1/20 0.43
CHRM1 P11229 1/20 0.43
TBXA2R P21731 1/20 0.43
ADRA1A P35348 1/20 0.43
LMNA P02545 3/20 0.42
ALKBH5 Q6P6C2 1/20 0.42
SUCNR1 Q9BXA5 1/20 0.42
EGLN1 Q9GZT9 1/20 0.42
SLC22A6 Q4U2R8 1/20 0.38
MEN1 O00255 1/20 0.38
CYP1A2 P05177 1/20 0.38
THRB P10828 1/20 0.38
KMT2A Q03164 1/20 0.38
FFAR1 O14842 1/20 0.37
CPT2 P23786 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
NAALAD2 Q9Y3Q0 1/20 0.37
TSHR P16473 2/20 0.36
NFKB1 P19838 1/20 0.36

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
SCHEMBL28239313 0.94 ALDH1A1 (0.43) ALDH1A1HMGCRCHRM1TBXA2RADRA1A
SCHEMBL28239229 0.92 ALDH1A1 (0.42) ALDH1A1HMGCRCHRM1TBXA2RADRA1A
SCHEMBL28485604 0.85 ALDH1A1 (0.47) ALDH1A1HMGCRCHRM1TBXA2RADRA1A
SCHEMBL880688 0.78 ALDH1A1 (0.56) ALDH1A1HMGCRCHRM1TBXA2RADRA1A
SCHEMBL7398801 0.78 ALDH1A1 (0.43) ALDH1A1HMGCRCHRM1TBXA2RADRA1A
SCHEMBL1935141 0.78 ALDH1A1 (0.43) ALDH1A1HMGCRCHRM1TBXA2RADRA1A
SCHEMBL29093810 0.78 LMNA (0.42) ALDH1A1LMNAALKBH5SUCNR1EGLN1
SCHEMBL10940999 0.76 HMGCR (0.48) ALDH1A1HMGCRCHRM1TBXA2RADRA1A
SCHEMBL381780 0.76 ALDH1A1 (0.52) ALDH1A1LMNAALKBH5SUCNR1EGLN1
SCHEMBL30017023 0.76 ALDH1A1 (0.53) ALDH1A1HMGCRCHRM1TBXA2RADRA1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3448561-B1 CATALYST, ITS PREPARATION AND USE IN THE CONVERSION OF OXYGEN-CONTAINING COMPOUNDS SCG CHEMICALS CO LTD (TH) 2021-06-02 EP claimed
WO-2017187187-A1 CATALYST, ITS PREPARATION AND USE IN THE CONVERSION OF OXYGEN-CONTAINING COMPOUNDS SCG CHEMICALS CO., LTD. (TH) 2017-11-02 WO claimed
EP-3448561-B1 CATALYST, ITS PREPARATION AND USE IN THE CONVERSION OF OXYGEN-CONTAINING COMPOUNDS SCG CHEMICALS CO LTD (TH) 2021-06-02 EP disclosed
WO-2017187187-A1 CATALYST, ITS PREPARATION AND USE IN THE CONVERSION OF OXYGEN-CONTAINING COMPOUNDS SCG CHEMICALS CO., LTD. (TH) 2017-11-02 WO disclosed
US-6488945-B2 PEARL PIGMENT CONTAINING AT LEAST MICA OR MICA TITAN MITSUBISHI PENCIL KABUSHIKI KAISHA (JP) 2002-12-03 US disclosed
US-4158044-A REACTING NITRIC OXIDE WITH A FERROUS CHELATE COMPLEX TO FORM A NITROSYL LIGAND MITSUI SHIPBUILDING AND ENGINEERING CO. (JP) 1979-06-12 US disclosed