SCHEMBL14537238

SCHEMBL14537238

COc1nc(Nc2ccc(OC)c(CI)c2)nc(NC2CCCCCC2)n1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.57
▸ MAPT P10636 2/20 0.57
▸ HTT P42858 2/20 0.57
▸ NPSR1 Q6W5P4 2/20 0.57
▸ MEN1 O00255 1/20 0.57
▸ KMT2A Q03164 1/20 0.57
▸ CTSS P25774 2/20 0.48
▸ CTSK P43235 2/20 0.48
▸ CTSL P07711 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.47
▸ GAA P10253 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ BCL6 P41182 1/20 0.46
▸ GALR2 O43603 3/20 0.44
▸ GALR1 P47211 3/20 0.44
▸ CCR4 P51679 1/20 0.42
▸ LMNA P02545 1/20 0.42

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
SCHEMBL14421446 0.92 CTSS (0.48) SMN1; SMN2MAPTHTTNPSR1MEN1
SCHEMBL14472384 0.91 SMN1; SMN2 (0.48) SMN1; SMN2MAPTHTTNPSR1MEN1
SCHEMBL14533513 0.91 CTSS (0.50) SMN1; SMN2MAPTHTTNPSR1MEN1
SCHEMBL14533521 0.91 RAB9A (0.58) SMN1; SMN2MAPTHTTNPSR1MEN1
SCHEMBL14613060 0.90 CTSS (0.50) SMN1; SMN2MAPTHTTNPSR1MEN1
SCHEMBL14635367 0.88 CTSS (0.45) SMN1; SMN2MAPTHTTNPSR1MEN1
SCHEMBL14421462 0.88 SMN1; SMN2 (0.45) SMN1; SMN2MAPTHTTNPSR1MEN1
SCHEMBL14421461 0.87 BCL6 (0.45) SMN1; SMN2MAPTHTTNPSR1MEN1
SCHEMBL14421549 0.87 SMN1; SMN2 (0.44) SMN1; SMN2MAPTHTTNPSR1MEN1
SCHEMBL14421502 0.85 SMN1; SMN2 (0.43) SMN1; SMN2MAPTHTTNPSR1MEN1

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-20070122444-A1 Medical devices employing triazine compounds and compositions thereof DR. REDDY'S LABORATORIES LTD. (IN) 2007-05-31 — — 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-20070122444-A1 Medical devices employing triazine compounds and compositions thereof AREG, TGFB1, TGFB2 SMN1; SMN2 3890/4885MAPT 2787/4885HTT 573/4885

“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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