SCHEMBL8171265

SCHEMBL8171265

CN1CCN(C(=O)/C=C/c2ccc(-c3ccccc3F)s2)CC1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.53
▸ ALDH1A1 P00352 3/20 0.47
▸ GAA P10253 2/20 0.45
▸ CCNC P24863 2/20 0.43
▸ CDK8 P49336 2/20 0.43
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ LMNA P02545 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ L3MBTL1 Q9Y468 2/20 0.41
▸ GPR183 P32249 3/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ MAPT P10636 2/20 0.40
▸ MITF O75030 1/20 0.40
▸ HTT P42858 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
SCHEMBL3179535 1.00 POLB (0.53) POLBALDH1A1GAACCNCCDK8
SCHEMBL3170023 0.88 ALDH1A1 (0.52) POLBALDH1A1GAAMEN1KMT2A
SCHEMBL8176875 0.88 ALDH1A1 (0.52) POLBALDH1A1GAAMEN1KMT2A
SCHEMBL3174087 0.79 RAB9A (0.47) ALDH1A1GAAMEN1KMT2ALMNA
SCHEMBL3174082 0.79 RAB9A (0.47) ALDH1A1GAAMEN1KMT2ALMNA
SCHEMBL3169872 0.78 MAPK1 (0.49) ALDH1A1GAAKMT2AHPGD
SCHEMBL3169874 0.78 MAPK1 (0.49) ALDH1A1GAAKMT2AHPGD
SCHEMBL3179530 0.74 ESRRG (0.46) ALDH1A1KMT2ARAB9AHPGDKDM4E
SCHEMBL3164350 0.73 KMT2A (0.49) POLBALDH1A1MEN1KMT2ALMNA
SCHEMBL3617564 0.72 ESRRG (0.49) MEN1KMT2ALMNARAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8304438-B2 Heteroarylacrylamides and their use as pharmaceuticals SANOFI (FR) 2012-11-06 — — US disclosed
US-20100016272-A1 HETEROARYLACRYLAMIDES AND THEIR USE AS PHARMACEUTICALS SANOFI-AVENTIS (FR) 2010-01-21 — — US disclosed
EP-1939180-A1 Heteroarylacrylamides and their use as pharmaceuticals for the stimulation of the expression of endothelial NO synthase sanofi-aventis (FR) 2008-07-02 — — EP disclosed
WO-2008074413-A2 HETEROARYLACRYLAMIDES AND THEIR USE AS PHARMACEUTICALS FOR THE STIMULATION OF THE EXPRESSION OF ENDOTHELIAL NO SYNTHASE SANOFI-AVENTIS (FR) 2008-06-26 — — 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-20100016272-A1 HETEROARYLACRYLAMIDES AND THEIR USE AS PHARMACEUTICALS NOS3, PTGIS, NOS1 POLB 1734/4885ALDH1A1 2657/4885GAA 1721/4885

“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.

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