SCHEMBL5031382

SCHEMBL5031382

CCC(Nc1nc(Nc2ccc(OCc3ccccc3)c(Cl)c2)nc(NC2CCCCCC2)n1)C1CCCN1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL6 P41182 1/20 0.40
PTK6 Q13882 1/20 0.39
EGFR P00533 8/20 0.38
ERBB2 P04626 6/20 0.38
ERBB4 Q15303 1/20 0.38
RAB9A P51151 1/20 0.38
GRM4 Q14833 1/20 0.38
SOS1 Q07889 1/20 0.37
STK10 O94804 1/20 0.36
SLK Q9H2G2 1/20 0.36
CTSV O60911 1/20 0.35
PLAT P00750 1/20 0.35
CTSL P07711 1/20 0.35
CTSH P09668 1/20 0.35
CTSS P25774 1/20 0.35
CASP14 P31944 1/20 0.35
CTSK P43235 1/20 0.35
CASP6 P55212 1/20 0.35
CTSZ Q9UBR2 1/20 0.35
KDM4E B2RXH2 1/20 0.35

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
SCHEMBL5553372 0.91 BCL6 (0.43) BCL6RAB9ASOS1CTSVPLAT
SCHEMBL5550350 0.89 BCL6 (0.42) BCL6RAB9ASOS1CTSVPLAT
SCHEMBL5032200 0.88 BCL6 (0.50) BCL6RAB9ACTSVPLATCTSL
SCHEMBL5031413 0.82 RAB9A (0.54) BCL6PTK6EGFRERBB2RAB9A
SCHEMBL5549818 0.82 CTSS (0.39) BCL6RAB9ACTSVPLATCTSL
SCHEMBL4840726 0.81 RAB9A (0.41) BCL6RAB9ASOS1CTSVPLAT
SCHEMBL5553374 0.81 RAB9A (0.37) BCL6RAB9ACTSVPLATCTSL
SCHEMBL5550320 0.81 BCL6 (0.40) BCL6EGFRRAB9ACTSLCTSS
SCHEMBL5553411 0.80 CTSS (0.38) BCL6RAB9ACTSVPLATCTSL
Hydrochloric Acid SCHEMBL5555475 0.80 RAB9A (0.41) BCL6RAB9ASOS1CTSVPLAT

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 6 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
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

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-20050227983-A1 Triazine compounds and their analogs, compositions, and methods MYLK, SMAD3, GID4 BCL6 541/4885PTK6 1050/4885EGFR 353/4885

“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.