SCHEMBL714966

SCHEMBL714966

O=C(O)c1ccc(N/N=C/c2ccccc2)cc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 15/20 0.74
NPC1 O15118 14/20 0.74
GAA P10253 13/20 0.74
MAPT P10636 12/20 0.74
SMN1; SMN2 Q16637 8/20 0.74
MEN1 O00255 8/20 0.74
KMT2A Q03164 8/20 0.74
NFKB1 P19838 3/20 0.74
NFKB2 Q00653 3/20 0.74
RELA Q04206 3/20 0.74
POLB P06746 3/20 0.74
KDM4E B2RXH2 2/20 0.74
HSP90AA1 P07900 1/20 0.74
HPGD P15428 4/20 0.68
ALDH1A1 P00352 4/20 0.68
MITF O75030 3/20 0.68
MAPK1 P28482 2/20 0.68
NOX1 Q9Y5S8 2/20 0.67
PKM P14618 2/20 0.62
ATM Q13315 1/20 0.62

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
SCHEMBL714967 1.00 RAB9A (0.74) RAB9ANPC1GAAMAPTSMN1; SMN2
SCHEMBL2681914 0.93 RAB9A (0.74) RAB9ANPC1GAAMAPTSMN1; SMN2
SCHEMBL26935088 0.87 NPC1 (0.71) RAB9ANPC1GAAMAPTSMN1; SMN2
SCHEMBL30740076 0.87 NPC1 (0.71) RAB9ANPC1GAAMAPTSMN1; SMN2
SCHEMBL26915307 0.87 NPC1 (0.71) RAB9ANPC1GAAMAPTSMN1; SMN2
SCHEMBL5777496 0.85 RAB9A (1.00) RAB9ANPC1GAAMAPTSMN1; SMN2
SCHEMBL881829 0.85 RAB9A (1.00) RAB9ANPC1GAAMAPTSMN1; SMN2
SCHEMBL13297230 0.85 NPC1 (0.65) RAB9ANPC1GAAMAPTSMN1; SMN2
SCHEMBL4747964 0.84 CA1 (0.64) RAB9ANPC1GAAMAPTSMN1; SMN2
SCHEMBL4747962 0.84 CA1 (0.64) RAB9ANPC1GAAMAPTSMN1; SMN2

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-8124578-B2 Use of dynamic mixtures for a controlled release of fragrances FIRMENICH SA (CH) 2012-02-28 US disclosed
EP-1776334-B1 USE OF DYNAMIC MIXTURES FOR A CONTROLLED RELEASE OF FRAGRANCES FIRMENICH & CIE (CH) 2009-10-14 EP disclosed
US-20070141011-A1 USE OF DYNAMIC MIXTURES FOR A CONTROLLED RELEASE OF FRAGRANCES UNIVERSITE LOUIS PASTEUR (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-20070141011-A1 USE OF DYNAMIC MIXTURES FOR A CONTROLLED RELEASE OF FRAGRANCES TRPA1, HCN1, HCN4 RAB9A 3745/4885NPC1 2168/4885GAA 2966/4885

“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.