SCHEMBL4643769

SCHEMBL4643769

C=CCCOc1cccc(OCc2ccccc2)c1C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 3/20 0.56
KDM4E B2RXH2 3/20 0.54
PTGER1 P34995 3/20 0.48
PTGER4 P35408 1/20 0.48
PTGER3 P43115 1/20 0.48
PTGER2 P43116 1/20 0.48
BRD4 O60885 1/20 0.47
CCNB2 O95067 1/20 0.46
CDK1 P06493 1/20 0.46
CDK4 P11802 1/20 0.46
CCNB1 P14635 1/20 0.46
CCND1 P24385 1/20 0.46
CCNB3 Q8WWL7 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.45
MAPT P10636 1/20 0.45
MAPK1 P28482 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
SRD5A2 P31213 1/20 0.45
HTR1A P08908 1/20 0.44
ADRA1D P25100 1/20 0.44

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
SCHEMBL4643985 0.91 KDM4E (0.50) FOLH1KDM4EPTGER1PTGER4PTGER3
SCHEMBL4644482 0.88 KDM4E (0.48) FOLH1KDM4EPTGER1PTGER4PTGER3
SCHEMBL629367 0.87 KDM4E (0.47) FOLH1KDM4EPTGER1PTGER4PTGER3
SCHEMBL8204822 0.86 FOLH1 (0.69) FOLH1PTGER1BRD4L3MBTL1MAPT
SCHEMBL20802720 0.78 KDM4E (0.54) FOLH1KDM4EL3MBTL1SRD5A2ALDH1A1
SCHEMBL19336446 0.77 FOLH1 (0.62) FOLH1PTGER1L3MBTL1MAPTMAPK1
SCHEMBL1097870 0.77 FOLH1 (0.62) FOLH1PTGER1L3MBTL1MAPTMAPK1
SCHEMBL3315009 0.77 KDM4E (0.74) KDM4EMAPTTDP1ALDH1A1NPC1
SCHEMBL2897224 0.76 MRGPRX4 (0.62) FOLH1PTGER1L3MBTL1MAPTMAPK1
SCHEMBL10741653 0.76 FOLH1 (0.65) FOLH1PTGER1L3MBTL1MAPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080293782-A1 1,1,3-Trioxo-1,2,5-Thiadiazolidines and Their Use as Ptp-Ases Inhibitors NOVARTIS AG (CH) 2008-11-27 US disclosed
EP-1960377-A1 l , l , 3-TRI0X0-l , 2 , 5-THIADIAZ0LIDINES AND THEIR USE AS PTP-ASES INHIBITORS Novartis AG (CH) 2008-08-27 EP disclosed
WO-2007067614-A1 l, l, 3-TRI0X0-l, 2, 5-THIADIAZ0LIDINES AND THEIR USE AS PTP-ASES INHIBITORS NOVARTIS AG (CH) 2007-06-14 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080293782-A1 1,1,3-Trioxo-1,2,5-Thiadiazolidines and Their Use as Ptp-Ases Inhibitors PTPRS, IRS1, PTPMT1 FOLH1 2899/4885KDM4E 3278/4885PTGER1 950/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.