SCHEMBL1128300

SCHEMBL1128300

Cc1cc(SC(F)(F)F)ccc1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.47
ESR1 P03372 11/20 0.45
TDP1 Q9NUW8 2/20 0.45
TP53 P04637 1/20 0.45
ESR2 Q92731 8/20 0.42
AR P10275 3/20 0.42
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 2/20 0.42
PDE10A Q9Y233 1/20 0.42
MAPT P10636 2/20 0.38
MAPK1 P28482 2/20 0.38
LMNA P02545 1/20 0.38
TSHR P16473 1/20 0.38
HTT P42858 1/20 0.38
PTPN1 P18031 1/20 0.37
PTPRZ1 P23471 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
G6PD P11413 1/20 0.37

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
SCHEMBL9331677 0.82 ESR1 (0.52) ESR1TDP1TP53ESR2AR
SCHEMBL12828098 0.81 SMN1; SMN2 (0.51) SMN1; SMN2TDP1TP53ARKDM4E
SCHEMBL1022506 0.78 ALDH1A1 (0.54) SMN1; SMN2TDP1KDM4EALDH1A1MAPT
SCHEMBL900729 0.78 SMN1; SMN2 (0.49) SMN1; SMN2TDP1TP53KDM4EALDH1A1
SCHEMBL16707555 0.78 SMN1; SMN2 (0.49) SMN1; SMN2TDP1TP53ARKDM4E
SCHEMBL31426312 0.76 TDP1 (0.54) ESR1TDP1TP53ESR2AR
SCHEMBL29438804 0.76 TP53 (0.54) ESR1TDP1TP53ESR2AR
SCHEMBL1549791 0.76 TDP1 (0.54) ESR1TDP1TP53ESR2AR
SCHEMBL51244 0.76 TP53 (0.54) ESR1TDP1TP53ESR2AR
SCHEMBL4457225 0.76 TSHR (0.45) SMN1; SMN2ESR1TDP1ESR2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8188098-B2 GPR119 receptor agonists HOFFMANN-LA ROCHE INC. (US) 2012-05-29 US disclosed
CN-102036991-A GPR119 receptor agonists HOFFMANN LA ROCHE 2011-04-27 CN disclosed
EP-2283019-A1 GPR119 RECEPTOR AGONISTS F. Hoffmann-La Roche AG (CH) 2011-02-16 EP disclosed
WO-2009141238-A1 GPR119 RECEPTOR AGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2009-11-26 WO disclosed
US-20090286812-A1 GPR119 Receptor Agonists ERICKSON SHAWN DAVID 2009-11-19 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-20090286812-A1 GPR119 Receptor Agonists GPR119, GPR27, GPR139 SMN1; SMN2 2213/4885ESR1 368/4885TDP1 4715/4885

“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.