SCHEMBL7065124

SCHEMBL7065124

COc1cc(OC)cc(C(=O)c2cc3ccnc(S(=O)(=O)c4ccccc4)c3[nH]2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C9 P11712 1/20 0.43
TSHR P16473 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
PIK3CA P42336 1/20 0.42
MAPT P10636 3/20 0.40
LMNA P02545 3/20 0.40
RAB9A P51151 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KAT6A Q92794 2/20 0.39
NPC1 O15118 1/20 0.38
F2 P00734 1/20 0.37
BCAT1 P54687 1/20 0.37
KDM4E B2RXH2 2/20 0.37
NPSR1 Q6W5P4 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
PDGFRB P09619 3/20 0.37

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
SCHEMBL7612318 0.82 CASP3 (0.39) KMT2AMAPTLMNASMN1; SMN2NPSR1
SCHEMBL7065226 0.78 FBP1 (0.42) MEN1KMT2ACYP1A2CYP3A4CYP2C9
SCHEMBL7066081 0.70 KAT6A (0.48) MEN1KMT2ACYP1A2CYP3A4CYP2C9
SCHEMBL7067343 0.67 TUBB4A (0.45) KDM4E
SCHEMBL4271295 0.66 KMT2A (0.52) MEN1KMT2ACYP1A2CYP3A4CYP2C9
SCHEMBL709521 0.65 FLT3 (0.77) MEN1KMT2ACYP1A2CYP3A4CYP2C9
SCHEMBL5716771 0.64 MEN1 (0.57) MEN1KMT2ACYP1A2CYP3A4CYP2C9
SCHEMBL2464374 0.64 HTT (0.59) MEN1KMT2ACYP1A2LMNARAB9A
SCHEMBL16797503 0.64 PKM (0.57) PIK3CAMAPTSMN1; SMN2F2KDM4E
SCHEMBL10936788 0.63 RXRA (0.47) MEN1KMT2ACYP1A2CYP3A4CYP2C9

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-20030158216-A1 2-acyl indole derivatives and their use as antitumor agents BAXTER ONCOLOGY GMBH 2003-08-21 US disclosed
US-20020091124-A1 2-acyl indole derivatives and their use as antitumor agents BECKERS THOMAS (DE) 2002-07-11 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-20030158216-A1 2-acyl indole derivatives and their use as antitumor agents IDO1, IDO2, INMT MEN1 1405/4885KMT2A 554/4885CYP1A2 469/4885
US-20020091124-A1 2-acyl indole derivatives and their use as antitumor agents IDO1, IDO2, INMT MEN1 1405/4885KMT2A 554/4885CYP1A2 469/4885

“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.