SCHEMBL9529272

SCHEMBL9529272

CCOC(=O)CC1(O)OC(=O)c2ccccc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP2 O95551 3/20 0.47
MAPT P10636 2/20 0.47
KDM4E B2RXH2 1/20 0.47
APAF1 O14727 1/20 0.47
NSD2 O96028 1/20 0.47
ABL1 P00519 1/20 0.47
GALK1 P51570 1/20 0.47
BLM P54132 1/20 0.47
PPP1CA P62136 1/20 0.47
RIN1 Q13671 1/20 0.47
SENP8 Q96LD8 1/20 0.47
SENP7 Q9BQF6 1/20 0.47
SENP6 Q9GZR1 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.46
ALDH1A1 P00352 7/20 0.43
CYP1A2 P05177 2/20 0.41
LMNA P02545 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL9529242 0.82 PTPRC (0.39) TDP2MAPTKDM4EAPAF1NSD2
SCHEMBL9502317 0.78 SMN1; SMN2 (0.47) TDP2MAPTKDM4EAPAF1NSD2
Acetic Acid SCHEMBL9529275 0.76 SMN1; SMN2 (0.47) TDP2MAPTKDM4EAPAF1NSD2
SCHEMBL6271326 0.73 NPSR1 (0.49) TDP2MAPTKDM4EAPAF1NSD2
SCHEMBL21325292 0.73 NPSR1 (0.49) TDP2MAPTKDM4EAPAF1NSD2
SCHEMBL24981178 0.73 ALDH1A1 (0.44) TDP2MAPTKDM4EAPAF1NSD2
SCHEMBL29502553 0.73 NPSR1 (0.49) TDP2MAPTKDM4EAPAF1NSD2
SCHEMBL17051306 0.73 APEX1 (0.47) TDP2MAPTKDM4EAPAF1NSD2
SCHEMBL12185540 0.72 SMN1; SMN2 (0.47) TDP2MAPTKDM4EAPAF1NSD2
SCHEMBL11110321 0.72 ALDH1A1 (0.47) TDP2MAPTKDM4EAPAF1NSD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0295051-B1 PREPARATION OF OXOPHTHALAZINYL ACETIC ACIDS HAVING BENZOTHIAZOLE OR OTHER HETEROCYCLIC SIDE CHAINS PFIZER INC. (US) 1993-06-09 EP disclosed
US-4900844-A Intermediates for the preparation of oxophthalazinyl acetic acids having benzothiazole or other heterocyclic side chains PFIZER INC. (US) 1990-02-13 US disclosed
US-4868301-A Processes and intermediates for the preparation of oxophthalazinyl acetic acids having benzothiazole or other heterocyclic side chains PFIZER INC. (US) 1989-09-19 US disclosed
EP-0295051-A2 Preparation of oxophthalazinyl acetic acids having benzothiazole or other heterocyclic side chains PFIZER INC. (US) 1988-12-14 EP disclosed