SCHEMBL6830175

SCHEMBL6830175

Cc1sc(C(=O)Nc2ccc(C#N)cc2C(=O)O)cc1S(=O)(=O)N1CCCC2CCCCC21

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALB P02768 3/20 0.46
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
ALDH1A1 P00352 3/20 0.35
POLB P06746 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
TP53 P04637 1/20 0.35
CHRNA7 P36544 2/20 0.34
HCRTR1 O43613 1/20 0.34
HCRTR2 O43614 1/20 0.34
PPARG P37231 1/20 0.34
PPARD Q03181 1/20 0.34
PPARA Q07869 1/20 0.34
MAPK11 Q15759 1/20 0.33
MAPK14 Q16539 1/20 0.33
PRSS12 P56730 2/20 0.33
PDE7A Q13946 2/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL6830277 0.90 ALB (0.45) ALBMEN1KMT2AALDH1A1POLB
SCHEMBL6834003 0.88 ALB (0.42) ALB
SCHEMBL6830587 0.88 ALB (0.44) ALBMEN1KMT2AALDH1A1POLB
SCHEMBL6821795 0.87 KMT2A (0.43) ALBMEN1KMT2AALDH1A1POLB
SCHEMBL6932502 0.86 ALB (0.54) ALBMEN1KMT2AALDH1A1POLB
SCHEMBL6818191 0.86 ALB (0.42) ALBMEN1KMT2AALDH1A1POLB
SCHEMBL6930797 0.85 ALB (0.53) ALBMEN1KMT2AALDH1A1POLB
SCHEMBL6833363 0.85 ALB (0.46) ALBMEN1KMT2AALDH1A1POLB
SCHEMBL6817870 0.85 ALB (0.51) ALBMEN1KMT2AALDH1A1POLB
SCHEMBL6814358 0.85 ALB (0.51) ALBMEN1KMT2AALDH1A1POLB

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 ALB 1417/4885MEN1 4132/4885KMT2A 2853/4885

“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.