SCHEMBL13486970

SCHEMBL13486970

CCCCCCCN1C(=O)c2ccc(NC(C)C)cc2C1=O

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.46
▸ KDM4E B2RXH2 5/20 0.46
▸ HPGD P15428 3/20 0.46
▸ HSD17B10 Q99714 3/20 0.46
▸ DDB1 Q16531 1/20 0.44
▸ CRBN Q96SW2 1/20 0.44
▸ KMT2A Q03164 2/20 0.43
▸ MAPK1 P28482 3/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ CHRM2 P08172 1/20 0.42
▸ CES1 P23141 2/20 0.42
▸ CDC25A P30304 2/20 0.42
▸ MAOB P27338 2/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL10451411 0.79 CNR2 (0.50) —
SCHEMBL2892202 0.79 CNR2 (0.50) —
SCHEMBL12235859 0.78 ALDH1A1 (0.73) ALDH1A1KDM4EHPGDHSD17B10KMT2A
SCHEMBL22080751 0.77 ALDH1A1 (0.60) ALDH1A1KDM4EHPGDHSD17B10KMT2A
SCHEMBL14560519 0.76 HSD17B10 (0.62) ALDH1A1KDM4EHSD17B10KMT2AMAPK1
SCHEMBL145135 0.76 ALDH1A1 (0.60) ALDH1A1KDM4EHPGDHSD17B10KMT2A
SCHEMBL10451307 0.76 ACHE (0.49) ALDH1A1KDM4EHPGDKMT2AMEN1
SCHEMBL12979075 0.76 ALDH1A1 (0.60) ALDH1A1KDM4EHPGDHSD17B10KMT2A
SCHEMBL2665904 0.75 CHRM2 (0.64) KDM4ECHRM2
SCHEMBL23731163 0.74 CES1 (0.68) ALDH1A1KMT2AMEN1CHRM2CES1

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-8362234-B2 Solid support reagents for synthesis ARCHEMIX LLC 2013-01-29 — — US disclosed
US-20100041866-A1 Solid Support Reagents for Synthesis ARCHEMIX CORP. (US) 2010-02-18 — — 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-20100041866-A1 Solid Support Reagents for Synthesis C1R, CBR1, CBR3 ALDH1A1 2676/4885KDM4E 1835/4885HPGD 2784/4885

“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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