SCHEMBL6231983

SCHEMBL6231983

COc1ccc(Nc2nc(N)nc(NC3CCCCCC3)n2)cc1F

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.58
BCL6 P41182 1/20 0.54
GALR1 P47211 8/20 0.52
CTSL P07711 1/20 0.50
CTSS P25774 1/20 0.50
CTSK P43235 1/20 0.50
GALR2 O43603 7/20 0.49
MEN1 O00255 1/20 0.48
MAPT P10636 1/20 0.48
HTT P42858 1/20 0.48
KMT2A Q03164 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
RAB9A P51151 1/20 0.47

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
SCHEMBL4836523 0.94 BCL6 (0.59) SMN1; SMN2BCL6GALR1CTSLCTSS
SCHEMBL4835239 0.94 BCL6 (0.59) SMN1; SMN2BCL6GALR1CTSLCTSS
SCHEMBL4832326 0.94 BCL6 (0.59) SMN1; SMN2BCL6GALR1CTSLCTSS
SCHEMBL5553364 0.90 BCL6 (0.53) SMN1; SMN2BCL6GALR1CTSLCTSS
SCHEMBL14417600 0.90 BCL6 (0.55) SMN1; SMN2BCL6GALR1CTSLCTSS
SCHEMBL14585681 0.90 BCL6 (0.55) SMN1; SMN2BCL6GALR1CTSLCTSS
SCHEMBL4838260 0.89 RAB9A (0.62) SMN1; SMN2BCL6GALR1CTSLCTSS
SCHEMBL4832475 0.89 BCL6 (0.54) SMN1; SMN2BCL6GALR1CTSLCTSS
SCHEMBL4832194 0.89 BCL6 (0.54) SMN1; SMN2BCL6GALR1CTSLCTSS
SCHEMBL4832445 0.88 BCL6 (0.51) SMN1; SMN2BCL6GALR1CTSLCTSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1560817-A1 METHODS AND COMPOSITIONS OF NOVEL TRIAZINE COMPOUNDS Reddy US Therapeutics, Inc. (US) 2005-08-10 EP claimed
WO-2004026844-A9 METHODS AND COMPOSITIONS OF NOVEL TRIAZINE COMPOUNDS REDDY US THERAPEUTICS INC (US) 2004-11-11 WO claimed
WO-2004026844-A1 METHODS AND COMPOSITIONS OF NOVEL TRIAZINE COMPOUNDS REDDY US THERAPEUTICS, INC. (US) 2004-04-01 WO claimed
US-7335656-B2 Stent with a disposed traiazine compound such as 6-(3-Chloro-4-methoxy-phenoxy)-N-cycloheptyl-N'-methyl-N'-(1-methyl-piperidin-4-yl)-[1,3,5]triazine-2,4-diamine for inhibiting smooth muscle proliferation; restenosis and atherosclerosis REDDY US THERAPEUTICS, INC. (US) 2008-02-26 US disclosed
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 3890/4885BCL6 2802/4885GALR1 1210/4885

“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.