SCHEMBL3910148

SCHEMBL3910148

O=C(OCCC(O)(CNc1ccc(F)c(F)c1)c1ccc(Cl)c(Cl)c1)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.40
RAB9A P51151 3/20 0.40
MAPT P10636 6/20 0.35
ALDH1A1 P00352 3/20 0.35
MEN1 O00255 6/20 0.35
KMT2A Q03164 6/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
LMNA P02545 2/20 0.35
TDP1 Q9NUW8 1/20 0.34
ATM Q13315 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
PLA2G7 Q13093 1/20 0.34
GAA P10253 1/20 0.34
AGTR1 P30556 1/20 0.34
MAPK1 P28482 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
HTT P42858 1/20 0.34

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
SCHEMBL3902832 0.90 NPC1 (0.41) NPC1RAB9AMAPTMEN1KMT2A
SCHEMBL3907379 0.89 NPC1 (0.40) NPC1RAB9AMAPTALDH1A1MEN1
SCHEMBL3895810 0.87 NPC1 (0.40) NPC1RAB9AMAPTALDH1A1MEN1
SCHEMBL4630752 0.79 TDP1 (0.38) NPC1RAB9AALDH1A1MEN1KMT2A
SCHEMBL4630560 0.78 KCNN4 (0.38) NPC1RAB9AMAPTALDH1A1MEN1
SCHEMBL4630209 0.78 TDP1 (0.37) NPC1RAB9AMAPTALDH1A1MEN1
SCHEMBL3909047 0.78 TDP1 (0.43) NPC1RAB9AALDH1A1MEN1KMT2A
SCHEMBL3899975 0.78 LMNA (0.34) ALDH1A1MEN1KMT2ALMNATDP1
SCHEMBL15190372 0.78 MAPT (0.40) NPC1RAB9AMAPTALDH1A1MEN1
Hydrochloric Acid SCHEMBL6949561 0.77 TDP1 (0.42) NPC1RAB9AALDH1A1SMN1; SMN2LMNA

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-7521449-B2 4-arylmorpholin-3-one derivatives, their preparation and therapeutic use thereof SANOFI-AVENTIS (FR) 2009-04-21 US disclosed
US-20070142349-A1 4-ARYLMORPHOLIN-3-ONE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2007-06-21 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-20070142349-A1 4-ARYLMORPHOLIN-3-ONE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE THEREOF ADRB3, ADRA2C, OPRK1 NPC1 625/4885RAB9A 2712/4885MAPT 1439/4885

“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.