SCHEMBL15869746

SCHEMBL15869746

COc1ccc(OCCOc2ccccc2)c(C)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.51
PPARD Q03181 2/20 0.51
PPARA Q07869 1/20 0.51
NPSR1 Q6W5P4 1/20 0.50
TDP1 Q9NUW8 3/20 0.49
L3MBTL1 Q9Y468 5/20 0.49
DRD2 P14416 3/20 0.49
DRD4 P21917 3/20 0.49
DRD3 P35462 2/20 0.49
MAPK1 P28482 1/20 0.49
MAPT P10636 5/20 0.47
HPGD P15428 2/20 0.47
KMT2A Q03164 2/20 0.47
RAB9A P51151 2/20 0.47
NPC1 O15118 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
LMNA P02545 1/20 0.47
ATM Q13315 1/20 0.46
MEN1 O00255 1/20 0.46
CYP1A2 P05177 1/20 0.46

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
SCHEMBL15869774 0.87 HPGD (0.50) NPSR1TDP1L3MBTL1DRD2DRD4
SCHEMBL12311777 0.84 CA12 (0.45) PPARDNPSR1TDP1L3MBTL1MAPK1
SCHEMBL22135547 0.84 TLR8 (0.51) PPARGPPARDPPARATDP1L3MBTL1
SCHEMBL5286863 0.83 L3MBTL1 (0.55) TDP1L3MBTL1DRD2DRD4DRD3
SCHEMBL9808196 0.81 HPGD (0.58) NPSR1TDP1L3MBTL1MAPK1MAPT
SCHEMBL1911835 0.81 MTNR1A (0.48) PPARDL3MBTL1MAPTKMT2ARAB9A
SCHEMBL386935 0.81 L3MBTL1 (0.65) NPSR1TDP1L3MBTL1DRD2DRD4
SCHEMBL15869672 0.80 SCN4A (0.56) PPARGPPARDNPSR1DRD2DRD4
SCHEMBL4337645 0.80 DRD2 (0.69) TDP1L3MBTL1DRD2DRD4DRD3
SCHEMBL12311779 0.79 TLR8 (0.54) PPARGPPARDPPARAL3MBTL1MAPT

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
US-9056862-B2 Thioxothiazolidine derivative having Ras function inhibitory effect NATIONAL UNIVERSITY CORPORATION KOBE UNIVERSITY (JP) 2015-06-16 US disclosed
US-9056862-B2 Thioxothiazolidine derivative having Ras function inhibitory effect NATIONAL UNIVERSITY CORPORATION KOBE UNIVERSITY (JP) 2015-06-16 US disclosed
US-20140194412-A1 THIOXOTHIAZOLIDINE DERIVATIVE HAVING RAS FUNCTION INHIBITORY EFFECT KNC LABORATORIES CO., LTD. (JP) 2014-07-10 US disclosed
US-20140194412-A1 THIOXOTHIAZOLIDINE DERIVATIVE HAVING RAS FUNCTION INHIBITORY EFFECT KNC LABORATORIES CO., LTD. (JP) 2014-07-10 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 (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-20140194412-A1 THIOXOTHIAZOLIDINE DERIVATIVE HAVING RAS FUNCTION INHIBITORY EFFECT KRAS, NRAS, RASSF5 PPARG 3327/4885PPARD 3238/4885PPARA 3840/4885

“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.