SCHEMBL19317331

SCHEMBL19317331

Cc1cc(C(=O)OCCOCCN2CCOCC2)ccc1C(C)(C)C

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.55
KDM4E B2RXH2 3/20 0.54
GAA P10253 2/20 0.54
PKM P14618 1/20 0.54
SMN1; SMN2 Q16637 3/20 0.53
ATM Q13315 1/20 0.53
HTR7 P34969 3/20 0.49
ALDH1A1 P00352 2/20 0.47
HPGD P15428 1/20 0.47
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
KMT2A Q03164 2/20 0.45
LMNA P02545 1/20 0.45
MEN1 O00255 1/20 0.45
POLB P06746 2/20 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
SCHEMBL19317249 0.93 L3MBTL1 (0.63) L3MBTL1KDM4EGAAPKMSMN1; SMN2
SCHEMBL19317296 0.91 KDM4E (0.65) L3MBTL1KDM4EGAAPKMSMN1; SMN2
SCHEMBL19317330 0.89 KDM4E (0.59) L3MBTL1KDM4EGAAPKMSMN1; SMN2
SCHEMBL19321948 0.88 L3MBTL1 (0.61) L3MBTL1KDM4EGAAPKMSMN1; SMN2
SCHEMBL19354877 0.85 L3MBTL1 (0.60) L3MBTL1KDM4EGAAPKMSMN1; SMN2
SCHEMBL19317247 0.83 KMT2A (0.56) L3MBTL1KDM4EGAASMN1; SMN2ATM
SCHEMBL19317250 0.82 KMT2A (0.59) L3MBTL1KDM4ESMN1; SMN2HTR7ALDH1A1
SCHEMBL19354673 0.81 L3MBTL1 (0.53) L3MBTL1KDM4EGAAPKMSMN1; SMN2
SCHEMBL19321935 0.81 L3MBTL1 (0.70) L3MBTL1KDM4EGAAPKMSMN1; SMN2
SCHEMBL19354545 0.80 L3MBTL1 (0.84) L3MBTL1KDM4EGAAPKMSMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10544113-B2 Thiazolidinone compounds and use thereof NATIONAL HEALTH RESEARCH INSTITUTE (TW) 2020-01-28 US disclosed
US-20170253569-A1 THIAZOLIDINONE COMPOUNDS AND USE THEREOF REGENTS OF THE UNIVERSITY OF MINNESOTA 2017-09-07 US disclosed
US-20170253569-A1 THIAZOLIDINONE COMPOUNDS AND USE THEREOF REGENTS OF THE UNIVERSITY OF MINNESOTA 2017-09-07 US 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 (2 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-10544113-B2 Thiazolidinone compounds and use thereof OPRL1, OPRD1, OPRK1 L3MBTL1 4651/4885KDM4E 3848/4885GAA 1589/4885
US-20170253569-A1 THIAZOLIDINONE COMPOUNDS AND USE THEREOF OPRL1, OPRD1, OPRK1 L3MBTL1 4651/4885KDM4E 3848/4885GAA 1589/4885

“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.