SCHEMBL19020654

SCHEMBL19020654

Nc1ccc(-c2ccc(C(=O)Nc3cccc4cccc(S(=O)(=O)O)c34)cc2)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CD40 P25942 4/20 0.69
CD40LG P29965 4/20 0.69
TTR P02766 1/20 0.48
FABP4 P15090 1/20 0.48
CCNA2 P20248 1/20 0.48
CDK2 P24941 1/20 0.48
MAPK14 Q16539 1/20 0.48
HDAC1 Q13547 2/20 0.47
NR4A1 P22736 1/20 0.47
SETD7 Q8WTS6 1/20 0.46
PRMT1 Q99873 1/20 0.46
HPGD P15428 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
ALDH1A1 P00352 1/20 0.45
CYP1A2 P05177 1/20 0.45
ATIC P31939 1/20 0.45
HSD17B10 Q99714 1/20 0.45
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
PDCD1 Q15116 1/20 0.42

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
SCHEMBL19020634 0.95 CD40 (0.77) CD40CD40LGTTRFABP4CCNA2
SCHEMBL11435576 0.84 CD40 (0.50) CD40CD40LGTTRFABP4CCNA2
SCHEMBL11500762 0.84 CD40 (0.53) CD40CD40LGTTRFABP4CCNA2
SCHEMBL19021224 0.83 CD40 (0.92) CD40CD40LGTTRFABP4CCNA2
SCHEMBL11436100 0.83 CD40 (0.49) CD40CD40LGHDAC1HPGDSMN1; SMN2
SCHEMBL6242038 0.83 CD40 (0.61) CD40CD40LGTTRFABP4CCNA2
SCHEMBL19020632 0.82 CD40 (1.00) CD40CD40LGTTRFABP4CCNA2
SCHEMBL23735897 0.81 HDAC1 (0.50) CD40CD40LGHDAC1SETD7PRMT1
SCHEMBL11758756 0.80 TIMP3 (0.54) CD40CD40LGTTRPRMT1HPGD
SCHEMBL20590980 0.80 CD40 (1.00) CD40CD40LGSMN1; SMN2MEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3389781-B1 INHIBITORS OF TNF SUPERFAMILY COSTIMULATORY INTERACTIONS AND METHODS FOR USES OF THE SAME UNIV MIAMI (US) 2021-08-11 EP disclosed
EP-3389781-B1 INHIBITORS OF TNF SUPERFAMILY COSTIMULATORY INTERACTIONS AND METHODS FOR USES OF THE SAME UNIV MIAMI (US) 2021-08-11 EP disclosed
US-10562848-B2 Inhibitors of TNF superfamily costimulatory interactions and methods for uses of the same UNIVERSITY OF MIAMI (US) 2020-02-18 US disclosed
US-10562848-B2 Inhibitors of TNF superfamily costimulatory interactions and methods for uses of the same UNIVERSITY OF MIAMI (US) 2020-02-18 US disclosed
US-20180370909-A1 INHIBITORS OF TNF SUPERFAMILY COSTIMULATORY INTERACTIONS AND METHODS FOR USES OF THE SAME UNIVERSITY OF MIAMI (US) 2018-12-27 US disclosed
WO-2017106436-A1 INHIBITORS OF TNF SUPERFAMILY COSTIMULATORY INTERACTIONS AND METHODS FOR USES OF THE SAME UNIVERSITY OF MIAMI (US) 2017-06-22 WO 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-20180370909-A1 INHIBITORS OF TNF SUPERFAMILY COSTIMULATORY INTERACTIONS AND METHODS FOR USES OF THE SAME CD40, TNFRSF9, TNFRSF1A CD40 1/4885CD40LG 7/4885TTR 2920/4885
US-10562848-B2 Inhibitors of TNF superfamily costimulatory interactions and methods for uses of the same CD40, TNFRSF9, TNFRSF1A CD40 1/4885CD40LG 7/4885TTR 2920/4885

“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.