SCHEMBL11062894

SCHEMBL11062894

CCOP(=O)(OCC)C(C(=O)O)P(=O)(O)O

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.42
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
PPARD Q03181 2/20 0.38
TSHR P16473 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
PGK1 P00558 1/20 0.36
PGK2 P07205 1/20 0.36
GAA P10253 1/20 0.36
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
RAB9A P51151 1/20 0.35
TP53 P04637 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
PGD P52209 1/20 0.34

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
SCHEMBL17937995 0.89 POLB (0.46) POLBCYP3A4CYP2C9CYP2C19PPARD
SCHEMBL9162193 0.78 TSHR (0.43) POLBCYP3A4CYP2C9CYP2C19PPARD
SCHEMBL7239642 0.77 MMP1 (0.39) POLBCYP3A4CYP2C9CYP2C19PPARD
SCHEMBL4050 0.74 POLB (0.44) POLBCYP3A4CYP2C9CYP2C19PPARD
SCHEMBL650629 0.74 POLB (0.48) POLBCYP3A4CYP2C9CYP2C19TSHR
SCHEMBL9067967 0.74 ALDH1A1 (0.41) POLBCYP3A4CYP2C9CYP2C19PPARD
SCHEMBL8549163 0.73 TSHR (0.43) POLBCYP3A4CYP2C9CYP2C19PPARD
SCHEMBL27666450 0.72 PPARD (0.43) POLBCYP3A4CYP2C9CYP2C19PPARD
SCHEMBL10400040 0.72 POLB (0.43) POLBCYP3A4CYP2C9CYP2C19PPARD
SCHEMBL13797901 0.72 CYP3A4 (0.47) POLBCYP3A4CYP2C9CYP2C19PPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4465689-A MONIC ACID ESTERS BEECHAM GROUP LIMITED (GB) 1984-08-14 US disclosed
US-4318856-A Antibacterial compounds BEECHAM GROUP LIMITED (GB) 1982-03-09 US disclosed
US-4289779-A HETEROCYCLIC ESTERS OF MONIC ACID; TREATMENT OF PENICILLIN-RESISTANT GONORRHEA BEECHAM GROUP LIMITED (GB) 1981-09-15 US disclosed
US-4283412-A MONIC ACID BEECHAM GROUP LIMITED (GB) 1981-08-11 US disclosed
US-4283411-A MONIC ACID BEECHAM GROUP LIMITED (GB) 1981-08-11 US disclosed
US-4267316-A HETEROCYCLIC ESTERS OF PSEUDOMONIC ACID; UROGENITAL DISORDERS; NEISSERIA; BRONCHIUS; VETERINARY MEDICINE BEECHAM GROUP LIMITED (GB) 1981-05-12 US disclosed
US-4256762-A ESTERS OF MONIC ACID BEECHAM GROUP LIMITED (GB) 1981-03-17 US disclosed
US-4256879-A BACTERICIDES, FURFURYLMETHYL, EPOXYPROPYL BEECHAM GROUP LIMITED (GB) 1981-03-17 US disclosed
US-4237161-A BRONCHITIS AND VENERAL DISEASE BEECHAM GROUP LIMITED (GB) 1980-12-02 US disclosed
US-4235784-A Antibacterial compounds BEECHAM GROUP LIMITED (GB) 1980-11-25 US disclosed
US-4217447-A Antibacterial compounds BEECHAM GROUP LIMITED (GB) 1980-08-12 US disclosed
US-4217448-A MONIC ACID DERIVATIVES BEECHAM GROUP LIMITED (GB) 1980-08-12 US disclosed
US-4166863-A ACTIVE AGAINST HEMOPHILUS AND NEISSERIA BEECHAM GROUP LIMITED (GB) 1979-09-04 US disclosed
US-4152337-A KETONES BEECHAM GROUP LIMITED (GB) 1979-05-01 US disclosed
US-4102901-A MONIC ACID ESTERS BEECHAM GROUP LIMITED (GB) 1978-07-25 US disclosed
US-4102904-A MONIC ACID BEECHAM GROUP LIMITED (GB) 1978-07-25 US disclosed