SCHEMBL2292999

SCHEMBL2292999

O=C(Nc1ccc(F)cc1)ON=C1CCNCC1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.56
NPC1 O15118 3/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
ALDH1A1 P00352 2/20 0.56
GAA P10253 2/20 0.55
KCNA5 P22460 1/20 0.47
FAAH O00519 6/20 0.43
KDM4E B2RXH2 1/20 0.41
MELK Q14680 1/20 0.40

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
SCHEMBL3640469 0.80 RAB9A (0.55) RAB9ANPC1SMN1; SMN2ALDH1A1GAA
SCHEMBL2288939 0.74 RAB9A (0.49) RAB9ANPC1SMN1; SMN2ALDH1A1GAA
SCHEMBL2895136 0.71 NPC1 (0.65) RAB9ANPC1ALDH1A1FAAHKDM4E
SCHEMBL13028753 0.71 NPC1 (0.65) RAB9ANPC1ALDH1A1FAAHKDM4E
SCHEMBL2895139 0.71 NPC1 (0.65) RAB9ANPC1ALDH1A1FAAHKDM4E
SCHEMBL28635395 0.69 KMT2A (0.47) RAB9ANPC1SMN1; SMN2ALDH1A1GAA
SCHEMBL2095091 0.67 SMN1; SMN2 (0.67) RAB9ANPC1SMN1; SMN2ALDH1A1FAAH
SCHEMBL2291115 0.66 ALDH1A1 (0.61) RAB9ANPC1ALDH1A1GAAFAAH
SCHEMBL2095089 0.66 ALDH1A1 (0.55) RAB9ANPC1ALDH1A1GAAFAAH
SCHEMBL9425626 0.65 MEN1 (0.31) FAAH

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-20110190300-A1 AMIDE COMPOUNDS AND THE USE THEREOF EURO-CELTIQUE S.A. (LU) 2011-08-04 US disclosed
EP-2164326-A1 AMIDE COMPOUNDS AND THE USE THEREOF Euro-Celtique, S.A. (LU) 2010-03-24 EP disclosed
WO-2008150447-A1 AMIDE COMPOUNDS AND THE USE THEREOF EURO-CELTIQUE S.A. (LU) 2008-12-11 WO 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-20110190300-A1 AMIDE COMPOUNDS AND THE USE THEREOF CACNA1E, CACNA1B, CACNA1S RAB9A 2436/4885NPC1 1113/4885SMN1; SMN2 993/4885

“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.