SCHEMBL16036765

SCHEMBL16036765

Cc1ccc(S(=O)(=O)n2c(C3=CCCN(C(=O)OC(C)(C)C)C3)cc3c(Cl)ccnc32)cc1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DGAT2 Q96PD7 1/20 0.39
TGM2 P21980 9/20 0.37
F13A1 P00488 6/20 0.37
TGM1 P22735 3/20 0.37
KIT P10721 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HTT P42858 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
MMP13 P45452 1/20 0.35
PTGDR2 Q9Y5Y4 2/20 0.35
STS P08842 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
HTR6 P50406 1/20 0.34

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
SCHEMBL17535108 0.93 KIT (0.39) TGM2F13A1TGM1KITKDM4E
SCHEMBL15586811 0.89 KIT (0.39) DGAT2TGM2F13A1TGM1KIT
SCHEMBL16035864 0.88 KIT (0.46) DGAT2KITHTR6
SCHEMBL16535994 0.84 KIT (0.48) KITHTR6
SCHEMBL16536014 0.83 CCNT1 (0.45) TGM2F13A1TGM1KITKDM4E
SCHEMBL15526002 0.79 RET (0.46) TGM2F13A1TGM1MEN1KMT2A
SCHEMBL16051682 0.79 KDM4E (0.37) KDM4EALDH1A1HTTNPSR1PTGDR2
SCHEMBL16536488 0.79 MMP13 (0.38) TGM2F13A1TGM1KITKDM4E
SCHEMBL16041258 0.78 SYK (0.40) TGM2F13A1TGM1KDM4EALDH1A1
SCHEMBL16039457 0.78 CCNK (0.42) MMP13STS

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-8969375-B2 CDK9 kinase inhibitors ABBVIE, INC. (US) 2015-03-03 US disclosed
US-20140275153-A1 CDK9 KINASE INHIBITORS ABBIVE INC. 2014-09-18 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-20140275153-A1 CDK9 KINASE INHIBITORS CDK9, CDK19, CDK10 DGAT2 4588/4885TGM2 3196/4885F13A1 2065/4885

“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.