SCHEMBL16557441

SCHEMBL16557441

Cc1ccc(C)c(N(CC(=O)Nc2ccncc2C)S(=O)(=O)c2ccccc2)c1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 4/20 0.58
▸ TP53 P04637 2/20 0.58
▸ MAPT P10636 1/20 0.58
▸ THRB P10828 1/20 0.58
▸ LMNA P02545 2/20 0.58
▸ POLB P06746 2/20 0.55
▸ GAA P10253 1/20 0.55
▸ ALDH1A1 P00352 2/20 0.54
▸ HPGD P15428 5/20 0.52
▸ CYP3A4 P08684 1/20 0.49
▸ CYP2D6 P10635 1/20 0.49
▸ CYP2C9 P11712 1/20 0.49
▸ CYP2C19 P33261 1/20 0.49
▸ NPSR1 Q6W5P4 1/20 0.49
▸ ATM Q13315 1/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48

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
SCHEMBL16557455 0.87 LMNA (0.67) SMN1; SMN2TP53MAPTLMNAPOLB
SCHEMBL16557436 0.87 HPGD (0.63) SMN1; SMN2TP53MAPTTHRBLMNA
SCHEMBL16557440 0.85 LMNA (0.62) SMN1; SMN2TP53MAPTTHRBLMNA
SCHEMBL16557445 0.83 SMN1; SMN2 (0.62) SMN1; SMN2TP53MAPTTHRBLMNA
SCHEMBL16557452 0.82 LMNA (0.64) SMN1; SMN2TP53MAPTTHRBLMNA
SCHEMBL16557442 0.82 LMNA (0.56) SMN1; SMN2TP53MAPTTHRBLMNA
SCHEMBL16557446 0.82 LMNA (0.59) SMN1; SMN2TP53MAPTTHRBLMNA
SCHEMBL16557459 0.82 LMNA (0.58) SMN1; SMN2TP53MAPTTHRBLMNA
SCHEMBL16557435 0.82 POLB (0.55) SMN1; SMN2TP53MAPTTHRBLMNA
SCHEMBL15583843 0.81 HPGD (0.76) MAPTPOLBALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9790233-B2 Compositions and methods of modulating 15-PGDH activity CASE WESTERN RESERVE UNIVERSITY (US) 2017-10-17 — — US disclosed
US-20170165241-A1 COMPOSITIONS AND METHODS OF MODULATING 15-PGDH ACTIVITY BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM 2017-06-15 — — US disclosed
US-20150072998-A1 COMPOSITIONS AND METHODS OF MODULATING 15-PGDH ACTIVITY BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM 2015-03-12 — — 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-20170165241-A1 COMPOSITIONS AND METHODS OF MODULATING 15-PGDH ACTIVITY PTGS1, HPGD, PTGIS SMN1; SMN2 3855/4885TP53 4037/4885MAPT 4311/4885
US-20150072998-A1 COMPOSITIONS AND METHODS OF MODULATING 15-PGDH ACTIVITY PTGS1, HPGD, PTGIS SMN1; SMN2 3855/4885TP53 4037/4885MAPT 4311/4885

“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.

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