SCHEMBL14825327

SCHEMBL14825327

CSc1ccc(Cl)c(C(=O)Nc2ccc(N3CCCCC3)cc2)c1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 6/20 0.70
▸ MEN1 O00255 5/20 0.70
▸ MAPT P10636 11/20 0.65
▸ RAB9A P51151 7/20 0.65
▸ MAPK1 P28482 2/20 0.65
▸ SMN1; SMN2 Q16637 2/20 0.65
▸ TDP1 Q9NUW8 2/20 0.65
▸ L3MBTL1 Q9Y468 2/20 0.65
▸ LMNA P02545 1/20 0.65
▸ ATM Q13315 1/20 0.60
▸ GAA P10253 5/20 0.58
▸ NPC1 O15118 4/20 0.57
▸ ALDH1A1 P00352 5/20 0.55
▸ NPSR1 Q6W5P4 1/20 0.55
▸ CYP1A2 P05177 1/20 0.54
▸ CYP3A4 P08684 1/20 0.54
▸ CYP2C19 P33261 1/20 0.54
▸ GFER P55789 1/20 0.54
▸ KDM4E B2RXH2 2/20 0.54
▸ GLA P06280 1/20 0.54

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
SCHEMBL7128789 0.78 MAPT (0.81) KMT2AMEN1MAPTRAB9AMAPK1
Hydrochloric Acid SCHEMBL18045308 0.76 KMT2A (0.95) KMT2AMEN1MAPTRAB9AMAPK1
SCHEMBL7129858 0.76 MAPT (0.77) KMT2AMEN1MAPTRAB9AMAPK1
SCHEMBL17740321 0.75 KMT2A (0.75) KMT2AMEN1MAPTRAB9AMAPK1
SCHEMBL12637992 0.74 CRACR2A (0.53) KMT2AMEN1MAPTSMN1; SMN2L3MBTL1
SCHEMBL1669659 0.74 CRACR2A (0.63) MAPTSMN1; SMN2GAA
SCHEMBL22778815 0.72 MEN1 (0.73) KMT2AMEN1MAPTRAB9AMAPK1
SCHEMBL6689700 0.72 GFER (1.00) KMT2AMEN1MAPTRAB9AMAPK1
SCHEMBL1669149 0.71 CRACR2A (0.66) —
SCHEMBL17195429 0.71 KMT2A (0.62) KMT2AMEN1MAPTRAB9AMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130085133-A1 ANTI-VIRAL TREATMENT AND ASSAY TO SCREENFOR ANTI-VIRAL AGENT Sourthern Research Institute Office of Commercialization and Intellectual Prop. (US) 2013-04-04 — — 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-20130085133-A1 ANTI-VIRAL TREATMENT AND ASSAY TO SCREENFOR ANTI-VIRAL AGENT MAVS, SNRPE, LONP1 KMT2A 4174/4885MEN1 1632/4885MAPT 4642/4885

“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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