SCHEMBL10294897

SCHEMBL10294897

CC(=O)Nc1ccc(Sc2nc(Nc3ncc(C(C)C)s3)nc(N3CCN(CCO)CC3)n2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAD52 P43351 1/20 0.46
▸ RECQL P46063 1/20 0.46
▸ BLM P54132 1/20 0.46
▸ SRC P12931 2/20 0.46
▸ CDK2 P24941 1/20 0.42
▸ AURKA O14965 2/20 0.42
▸ AURKB Q96GD4 2/20 0.42
▸ RIPK1 Q13546 1/20 0.42
▸ KIT P10721 5/20 0.40
▸ DRD2 P14416 1/20 0.38
▸ HTR2A P28223 1/20 0.37
▸ DRD3 P35462 1/20 0.37
▸ FLT3 P36888 2/20 0.37
▸ ABL1 P00519 1/20 0.37
▸ SIK1 P57059 1/20 0.37
▸ SIK2 Q9H0K1 1/20 0.37
▸ SIK3 Q9Y2K2 1/20 0.37
▸ OGA O60502 1/20 0.36
▸ TNIK Q9UKE5 1/20 0.36
▸ CHRNA7 P36544 1/20 0.36

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
SCHEMBL10294720 0.93 AURKA (0.41) RAD52RECQLBLMSRCCDK2
SCHEMBL10295023 0.92 AURKB (0.42) RAD52RECQLBLMSRCAURKA
SCHEMBL10294893 0.91 AURKA (0.48) RAD52RECQLBLMSRCCDK2
SCHEMBL10295024 0.90 CCNE1 (0.44) SRCCDK2AURKAAURKBRIPK1
SCHEMBL13002159 0.90 RAD52 (0.48) RAD52RECQLBLMSRCAURKA
SCHEMBL10294479 0.89 HTR2A (0.40) SRCAURKAAURKBRIPK1KIT
SCHEMBL10295060 0.88 RAD52 (0.49) RAD52RECQLBLMSRCAURKA
SCHEMBL10294964 0.85 AURKA (0.43) RAD52RECQLBLMSRCAURKA
SCHEMBL10294739 0.84 AURKB (0.47) RAD52RECQLBLMAURKAAURKB
SCHEMBL10294754 0.84 AURKA (0.47) BLMSRCCDK2AURKAAURKB

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-20120172361-A1 TRIAZINE DERIVATIVES AND THEIR THERAPEUTICAL APPLICATIONS CALIFORNIA CAPITAL EQUITY, LLC (US) 2012-07-05 — — US disclosed
WO-2010144359-A1 TRIAZINE DERIVATIVES AND THEIR THERAPEUTICAL APPLICATIONS ABRAXIS BIOSCIENCE, LLC (US) 2010-12-16 — — 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-20120172361-A1 TRIAZINE DERIVATIVES AND THEIR THERAPEUTICAL APPLICATIONS CYP3A5, CYP11B2, ABCB1 RAD52 2669/4885RECQL 3585/4885BLM 1237/4885

“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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