SCHEMBL6834042

SCHEMBL6834042

CCN(CC)CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2ccc(C#N)cc2C(=O)O)sc1C

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.39
ALDH1A1 P00352 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
ALB P02768 2/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
CYP2C9 P11712 2/20 0.38
TP53 P04637 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
GAA P10253 1/20 0.38
APEX1 P27695 1/20 0.36
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
RXFP1 Q9HBX9 1/20 0.33
MCHR1 Q99705 1/20 0.33
DDR1 Q08345 1/20 0.33

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
SCHEMBL6821593 0.92 LMNA (0.39) LMNAALDH1A1SMN1; SMN2ALBMEN1
SCHEMBL6835831 0.85 ALB (0.38) LMNAALDH1A1SMN1; SMN2ALBMEN1
SCHEMBL6833913 0.85 ALB (0.38) LMNAALDH1A1SMN1; SMN2ALBMEN1
SCHEMBL6833250 0.85 ALB (0.40) LMNAALDH1A1SMN1; SMN2ALBMEN1
SCHEMBL7073951 0.82 TAS2R14 (0.39) LMNAALDH1A1ALBMEN1KMT2A
SCHEMBL6833716 0.80 ALB (0.38) ALDH1A1ALBMEN1KMT2ACYP2C9
SCHEMBL6818482 0.79 HTT (0.39) ALDH1A1ALBMEN1KMT2A
SCHEMBL7064764 0.78 ALB (0.46) ALDH1A1ALBMEN1KMT2ACYP3A4
SCHEMBL6834272 0.78 ALB (0.36) ALDH1A1ALBMEN1KMT2ACYP2C9
SCHEMBL6833721 0.78 MCOLN3 (0.44) LMNAALDH1A1SMN1; SMN2ALBMEN1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040110802-A1 Antibacterial benzoic acid derivatives PHARMACIA & UPJOHN COMPANY 2004-06-10 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-20040110802-A1 Antibacterial benzoic acid derivatives GABRD, GABBR1, GABRA1 LMNA 3376/4885ALDH1A1 170/4885SMN1; SMN2 2022/4885

“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.