SCHEMBL7807381

SCHEMBL7807381

CNNC(=O)C1=CN(CC(=O)c2cc([N+](=O)[O-])cs2)C=CC1

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.32
LMNA P02545 1/20 0.32
POLB P06746 1/20 0.32
MIF P14174 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL287368 0.94 MIF (0.34) MAPTLMNAPOLBMIFSMN1; SMN2
SCHEMBL661855 0.89 LMNA (0.33) MAPTLMNAPOLBMIF
SCHEMBL27473615 0.67 LMNA (0.31) MAPTLMNAPOLBMIF
SCHEMBL11213610 0.66 KMT2A (0.49) MAPTLMNAPOLBMIFSMN1; SMN2
SCHEMBL6694136 0.63 ALDH1A1 (0.56) MAPTLMNAPOLBMIFSMN1; SMN2
SCHEMBL287385 0.63 ALDH1A1 (0.46) MAPTPOLBSMN1; SMN2MEN1ALDH1A1
SCHEMBL660129 0.61 GAA (0.46) MAPTLMNAMEN1ALDH1A1KMT2A
SCHEMBL2789975 0.61 MAPT (0.48) MAPTLMNAMIFSMN1; SMN2MEN1
SCHEMBL1844829 0.60 MIF (0.43) MAPTLMNAPOLBMIFSMN1; SMN2
SCHEMBL298992 0.60 ALDH1A1 (0.38) MAPTLMNAPOLBSMN1; SMN2MEN1

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-20120046317-A1 NOVEL HETEROCYCLIC COMPOUNDS DUTT CHAITANYA (IN) 2012-02-23 US disclosed
WO-2010128528-A2 NOVEL HETEROCYCLIC COMPOUNDS TORRENT PHARMACEUTICALS LIMITED (IN) 2010-11-11 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-20120046317-A1 NOVEL HETEROCYCLIC COMPOUNDS AGER, REN, AGT MAPT 61/4885LMNA 123/4885POLB 2267/4885

“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.