SCHEMBL5031339

SCHEMBL5031339

COc1ccc(Nc2nc(NCCN)nc(NC3CCCCCC3)n2)cc1Cl

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL6 P41182 6/20 0.60
BCDIN3D Q7Z5W3 1/20 0.52
STK17B O94768 1/20 0.50
STK17A Q9UEE5 1/20 0.50
MAPT P10636 3/20 0.49
GAA P10253 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.48
RAB9A P51151 2/20 0.48
NPC1 O15118 1/20 0.48
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
LMNA P02545 1/20 0.47
CTSL P07711 1/20 0.46
CTSS P25774 1/20 0.46
CTSK P43235 1/20 0.46
HTT P42858 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
EPHB4 P54760 1/20 0.44
GALR2 O43603 1/20 0.42
GALR1 P47211 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
SCHEMBL5033896 0.93 BCL6 (0.57) BCL6BCDIN3DSTK17BSTK17AMAPT
SCHEMBL4836573 0.89 BCL6 (0.68) BCL6MAPTGAASMN1; SMN2RAB9A
SCHEMBL4839482 0.89 BCL6 (0.60) BCL6MAPTGAASMN1; SMN2RAB9A
SCHEMBL5550961 0.87 BCL6 (0.58) BCL6STK17BSTK17AMAPTGAA
SCHEMBL4836855 0.87 BCL6 (0.54) BCL6STK17BSTK17AMAPTGAA
SCHEMBL4838606 0.86 SMN1; SMN2 (0.64) BCL6MAPTGAASMN1; SMN2RAB9A
SCHEMBL4829781 0.86 RAB9A (0.65) BCL6MAPTGAASMN1; SMN2RAB9A
SCHEMBL5033891 0.86 BCL6 (0.51) BCL6STK17BSTK17AMAPTGAA
SCHEMBL4839296 0.85 BCL6 (0.61) BCL6MAPTGAASMN1; SMN2RAB9A
SCHEMBL5029063 0.85 BCL6 (0.55) BCL6STK17BSTK17AMAPTGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7335770-B2 Triazine compounds and their analogs, compositions, and methods REDDY U5 THERAPEUTICS, INC. (US) 2008-02-26 US claimed
WO-2005103015-A1 TRIAZINE COMPOUNDS AND THEIR ANALOGS, COMPOSITIONS, AND METHODS REDDY US THERAPEUTICS, INC. (US) 2005-11-03 WO claimed
US-20050227983-A1 Triazine compounds and their analogs, compositions, and methods DR. REDDY'S LABORATORIES LTD. (IN) 2005-10-13 US claimed
US-7335770-B2 Triazine compounds and their analogs, compositions, and methods REDDY U5 THERAPEUTICS, INC. (US) 2008-02-26 US disclosed
US-7335770-B2 Triazine compounds and their analogs, compositions, and methods REDDY U5 THERAPEUTICS, INC. (US) 2008-02-26 US disclosed
US-7335770-B2 Triazine compounds and their analogs, compositions, and methods REDDY U5 THERAPEUTICS, INC. (US) 2008-02-26 US disclosed
WO-2005103015-A1 TRIAZINE COMPOUNDS AND THEIR ANALOGS, COMPOSITIONS, AND METHODS REDDY US THERAPEUTICS, INC. (US) 2005-11-03 WO disclosed
US-20050227983-A1 Triazine compounds and their analogs, compositions, and methods DR. REDDY'S LABORATORIES LTD. (IN) 2005-10-13 US disclosed
US-20050009820-A1 Thiochromenones used to combat painful conditions and neurodegenerative diseases BAYER HEALTHCARE AG (DE) 2005-01-13 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 (2 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-20050227983-A1 Triazine compounds and their analogs, compositions, and methods MYLK, SMAD3, GID4 BCL6 541/4885BCDIN3D 2549/4885STK17B 443/4885
US-20050009820-A1 Thiochromenones used to combat painful conditions and neurodegenerative diseases HTT, HMOX1, SNCA BCL6 3286/4885BCDIN3D 3329/4885STK17B 2123/4885

“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.