SCHEMBL4098190

SCHEMBL4098190

COc1ccc(C(=O)c2ccc(OCCc3ccc(OC)c(OC)c3)nc2)c(OC(C)(C)C(=O)OC(=O)C(F)(F)F)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.39
HTT P42858 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
NPC1 O15118 2/20 0.38
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
CYP3A4 P08684 2/20 0.38
CYP2C19 P33261 2/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
BCHE P06276 2/20 0.36
ACHE P22303 2/20 0.36
KCNH2 Q12809 1/20 0.36
SCN5A Q14524 1/20 0.36
EGFR P00533 1/20 0.35
CSK P41240 1/20 0.35
PPARG P37231 1/20 0.35
CYP1A2 P05177 1/20 0.35
TSHR P16473 1/20 0.35
MAPT P10636 4/20 0.35

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
SCHEMBL4099606 0.91 PPARG (0.35) SMN1; SMN2NPC1KMT2AMEN1KCNH2
Trifluoroacetic Acid SCHEMBL4098182 0.90 PPARG (0.41) LMNAHTTSMN1; SMN2NPC1KMT2A
SCHEMBL4093282 0.88 PPARG (0.40) SMN1; SMN2NPC1KMT2AMEN1PPARG
SCHEMBL4108540 0.88 KCNH2 (0.35) LMNANPC1KMT2AMEN1CYP3A4
SCHEMBL4103730 0.85 NPC1 (0.38) LMNAHTTSMN1; SMN2NPC1KMT2A
SCHEMBL4103438 0.84 POLB (0.40) LMNAHTTSMN1; SMN2NPC1KMT2A
SCHEMBL4105734 0.82 POLB (0.38) LMNAHTTSMN1; SMN2NPC1KMT2A
SCHEMBL4102685 0.82 NPC1 (0.37) LMNANPC1KMT2AMEN1CYP3A4
SCHEMBL4100119 0.82 NPC1 (0.37) LMNASMN1; SMN2NPC1KMT2AMEN1
SCHEMBL4097382 0.82 PTGDR2 (0.38) NPC1PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090054435-A1 Phenoxyalkanoic Acid Compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-02-26 US disclosed
EP-1911738-A1 PHENOXYALKANOIC ACID COMPOUND Takeda Pharmaceutical Company Limited (JP) 2008-04-16 EP 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-20090054435-A1 Phenoxyalkanoic Acid Compound PNLIP, GPR119, LIPC LMNA 2967/4885HTT 1222/4885SMN1; SMN2 4798/4885

“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.