SCHEMBL5221546

SCHEMBL5221546

CCCC(=O)N1CCC(C(=O)O)CC1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.57
L3MBTL1 Q9Y468 2/20 0.51
NPC1 O15118 1/20 0.48
GNAI3 P08754 4/20 0.47
GNAO1 P09471 4/20 0.47
GNAI1 P63096 4/20 0.47
LMNA P02545 1/20 0.47
CHRNB2 P17787 1/20 0.46
CHRNA3 P32297 1/20 0.46
CHRNA4 P43681 1/20 0.46
CHRNB3 Q05901 1/20 0.46
CHRNA6 Q15825 1/20 0.46
ITGB3 P05106 1/20 0.45
ITGA2B P08514 1/20 0.45
EPHX1 P07099 1/20 0.44
EPHX2 P34913 1/20 0.44
CREBBP Q92793 1/20 0.44

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
SCHEMBL9280678 0.89 GNAI3 (0.57) POLBL3MBTL1NPC1GNAI3GNAO1
SCHEMBL9428505 0.87 GNAI3 (0.64) POLBL3MBTL1NPC1GNAI3GNAO1
SCHEMBL10757141 0.86 GNAI3 (0.67) POLBL3MBTL1NPC1GNAI3GNAO1
SCHEMBL5606242 0.86 GNAI3 (0.67) POLBL3MBTL1NPC1GNAI3GNAO1
SCHEMBL10535735 0.86 GNAI3 (0.67) POLBL3MBTL1NPC1GNAI3GNAO1
SCHEMBL10535769 0.86 GNAI3 (0.67) POLBL3MBTL1NPC1GNAI3GNAO1
SCHEMBL10537382 0.86 GNAI3 (0.67) POLBL3MBTL1NPC1GNAI3GNAO1
SCHEMBL9427599 0.86 GNAI3 (0.67) POLBL3MBTL1NPC1GNAI3GNAO1
SCHEMBL27429183 0.85 NPC1 (0.48) POLBL3MBTL1NPC1GNAI3GNAO1
SCHEMBL4259604 0.84 L3MBTL1 (0.54) POLBL3MBTL1NPC1LMNAEPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200207726-A1 INDOLINYL SULFONAMIDE AND RELATED COMPOUNDS FOR USE AS AGONISTS OF RORY AND THE TREATMENT OF DISEASE LYCERA CORPORATION 2020-07-02 US disclosed
US-20120295903-A1 FLAVIN DERIVATIVES BLOUNT KENNETH F (US) 2012-11-22 US disclosed
EP-1765780-A1 PIPERIDINE COMPOUND AND PROCESS FOR PREPARING THE SAME TANABE SEIYAKU CO., LTD. (JP) 2007-03-28 EP disclosed
WO-2006004195-A1 PIPERIDINE COMPOUND AND PROCESS FOR PREPARING THE SAME TANABE SEIYAKU CO., LTD. (JP) 2006-01-12 WO disclosed
EP-1537106-A1 DIHYDROPYRAZOLOPYRIDINE COMPOUNDS Mitsubishi Pharma Corporation (JP) 2005-06-08 EP disclosed
WO-2004014910-A1 DIHYDROPYRAZOLOPYRIDINE COMPOUNDS MITSUBISHI PHARMA CORPORATION (JP) 2004-02-19 WO disclosed
US-5102890-A Anxiolytic agents RHONE-POULENC SANTE (FR) 1992-04-07 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-20200207726-A1 INDOLINYL SULFONAMIDE AND RELATED COMPOUNDS FOR USE AS AGONISTS OF RORY AND THE TREATMENT OF DISEASE RORA, RORC, RORB POLB 4324/4885L3MBTL1 4845/4885NPC1 2694/4885
US-20120295903-A1 FLAVIN DERIVATIVES BLVRB, FLAD1, FDPS POLB 1461/4885L3MBTL1 1081/4885NPC1 4376/4885

“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.