SCHEMBL4148533

SCHEMBL4148533

CC(C)(C)c1ccc(S(=O)(=O)Nc2cnc3[nH]c(C(=O)NC4CCCC4O)c(-c4ccco4)c3c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 1/20 0.39
ALDH1A1 P00352 3/20 0.37
LMNA P02545 3/20 0.37
BRD4 O60885 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
KMT2A Q03164 2/20 0.37
HTR1A P08908 1/20 0.37
HTR1D P28221 1/20 0.37
HTR1B P28222 1/20 0.37
HTR6 P50406 1/20 0.37
MEN1 O00255 1/20 0.37
CYP1A2 P05177 1/20 0.37
POLB P06746 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
KEAP1 Q14145 1/20 0.37
NFE2L2 Q16236 1/20 0.37
IKBKB O14920 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
SCHEMBL4148534 1.00 NR3C1 (0.39) NR3C1ALDH1A1LMNABRD4SMN1; SMN2
SCHEMBL3955415 0.88 SERPINE1 (0.43) ALDH1A1LMNABRD4SMN1; SMN2KMT2A
SCHEMBL3955418 0.88 SERPINE1 (0.43) ALDH1A1LMNABRD4SMN1; SMN2KMT2A
SCHEMBL4135800 0.88 CNR1 (0.39) LMNAHTR6POLBNAMPTROCK2
SCHEMBL4135797 0.88 CNR1 (0.39) LMNAHTR6POLBNAMPTROCK2
SCHEMBL4137983 0.87 HTR1A (0.37) NR3C1ALDH1A1LMNABRD4SMN1; SMN2
SCHEMBL4137985 0.87 HTR1A (0.37) NR3C1ALDH1A1LMNABRD4SMN1; SMN2
SCHEMBL4142664 0.85 BRD4 (0.37) ALDH1A1LMNABRD4SMN1; SMN2KMT2A
SCHEMBL4142667 0.85 BRD4 (0.37) ALDH1A1LMNABRD4SMN1; SMN2KMT2A
SCHEMBL4139174 0.84 ALDH1A1 (0.36) ALDH1A1LMNABRD4SMN1; SMN2KMT2A

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-20090098189-A1 AZAINDOLES AS INHIBITORS OF SOLUBLE ADENYLATE CYCLASE BAYER SCHERING PHARMA AG (DE) 2009-04-16 US claimed
US-20090098189-A1 AZAINDOLES AS INHIBITORS OF SOLUBLE ADENYLATE CYCLASE BAYER SCHERING PHARMA AG (DE) 2009-04-16 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-20090098189-A1 AZAINDOLES AS INHIBITORS OF SOLUBLE ADENYLATE CYCLASE ADCY1, ADCY5, ADCY2 NR3C1 2218/4885ALDH1A1 327/4885LMNA 4108/4885

“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.