SCHEMBL20657481

SCHEMBL20657481

CC(C)(C)c1ccc(S(=O)(=O)Nc2cc(N)ccc2N2CCOCC2)cc1

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.67
LMNA P02545 5/20 0.64
SMN1; SMN2 Q16637 3/20 0.64
ALDH1A1 P00352 8/20 0.60
CCR9 P51686 1/20 0.57
KMT2A Q03164 3/20 0.56
MAPT P10636 5/20 0.55
KDM4E B2RXH2 1/20 0.55
HTT P42858 1/20 0.54
BRPF1 P55201 1/20 0.53
POLB P06746 3/20 0.53
MEN1 O00255 2/20 0.53
MCOLN3 Q8TDD5 1/20 0.53
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2C19 P33261 1/20 0.50

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
SCHEMBL20657752 0.84 TP53 (0.64) TP53LMNASMN1; SMN2ALDH1A1CCR9
SCHEMBL11533596 0.77 LMNA (0.57) TP53LMNASMN1; SMN2ALDH1A1KMT2A
SCHEMBL4781525 0.74 ALDH1A1 (1.00) TP53LMNASMN1; SMN2ALDH1A1KMT2A
SCHEMBL17779217 0.72 MAPT (0.59) TP53LMNASMN1; SMN2ALDH1A1KMT2A
SCHEMBL17774618 0.72 MAPT (0.65) LMNASMN1; SMN2ALDH1A1KMT2AMAPT
SCHEMBL4782068 0.72 ALDH1A1 (0.83) TP53LMNASMN1; SMN2ALDH1A1KMT2A
SCHEMBL23355082 0.72 MCOLN3 (0.70) TP53LMNAALDH1A1KMT2ABRPF1
SCHEMBL15652359 0.70 MAPT (0.58) LMNASMN1; SMN2ALDH1A1KMT2AMAPT
SCHEMBL17774670 0.70 MAPT (0.79) LMNASMN1; SMN2ALDH1A1KMT2AMAPT
SCHEMBL5252021 0.70 ALDH1A1 (0.72) TP53LMNASMN1; SMN2ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200129458-A1 COMPOUND HAVING ENHANCING ACTIVITY FOR GLUCAGON-LIKE PEPTIDE-1 RECEPTOR ACTIONS AJINOMOTO CO., INC. (JP) 2020-04-30 US disclosed
US-20200129458-A1 COMPOUND HAVING ENHANCING ACTIVITY FOR GLUCAGON-LIKE PEPTIDE-1 RECEPTOR ACTIONS AJINOMOTO CO., INC. (JP) 2020-04-30 US disclosed
EP-3438091-A1 COMPOUND HAVING ENHANCING ACTIVITY FOR GLUCAGON-LIKE PEPTIDE-1 RECEPTOR ACTIONS AJINOMOTO CO., INC. (JP) 2019-02-06 EP disclosed
US-20190022039-A1 COMPOUND HAVING ENHANCING ACTIVITY FOR GLUCAGON-LIKE PEPTIDE-1 RECEPTOR ACTIONS AJINOMOTO CO., INC. (JP) 2019-01-24 US disclosed
US-20190022039-A1 COMPOUND HAVING ENHANCING ACTIVITY FOR GLUCAGON-LIKE PEPTIDE-1 RECEPTOR ACTIONS AJINOMOTO CO., INC. (JP) 2019-01-24 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-20200129458-A1 COMPOUND HAVING ENHANCING ACTIVITY FOR GLUCAGON-LIKE PEPTIDE-1 RECEPTOR ACTIONS GLP1R, GPR119, GIPR TP53 4210/4885LMNA 3342/4885SMN1; SMN2 3136/4885
US-20190022039-A1 COMPOUND HAVING ENHANCING ACTIVITY FOR GLUCAGON-LIKE PEPTIDE-1 RECEPTOR ACTIONS GLP1R, GPR119, GIPR TP53 4210/4885LMNA 3342/4885SMN1; SMN2 3136/4885

“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.