SCHEMBL5739481

SCHEMBL5739481

O=C1C2CCCN2C(=S)N1c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 1.00
POLB P06746 1/20 0.61
ALDH1A1 P00352 4/20 0.50
TDP1 Q9NUW8 1/20 0.50
PIK3C2B O00750 4/20 0.47
PIK3CD O00329 2/20 0.47
PIK3CB P42338 2/20 0.47
PIK3CG P48736 2/20 0.47
GAA P10253 1/20 0.45
GFER P55789 1/20 0.45
MEN1 O00255 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
SCHEMBL5742240 1.00 KMT2A (1.00) KMT2APOLBALDH1A1TDP1PIK3C2B
SCHEMBL5740340 0.95 KMT2A (0.91) KMT2APOLBALDH1A1TDP1PIK3C2B
SCHEMBL5740339 0.84 KMT2A (0.72) KMT2APOLBALDH1A1TDP1GAA
SCHEMBL11557413 0.81 KMT2A (0.68) KMT2APOLBALDH1A1GAAMEN1
SCHEMBL11560068 0.81 KMT2A (0.68) KMT2APOLBALDH1A1
SCHEMBL11557639 0.81 KMT2A (0.68) KMT2APOLBALDH1A1GAAMEN1
SCHEMBL10650530 0.80 KMT2A (0.67) KMT2APOLBALDH1A1TDP1GAA
SCHEMBL10644699 0.80 KMT2A (0.67) KMT2APOLBALDH1A1TDP1GAA
SCHEMBL10798950 0.80 KMT2A (0.67) KMT2APOLBALDH1A1TDP1GAA
SCHEMBL5740800 0.79 KMT2A (0.66) KMT2AALDH1A1TDP1GAAGFER

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024076928-A1 FLUOROPHORE-POLYMER CONJUGATES AND USES THEREOF ERISYON INC. (US) 2024-04-11 WO disclosed
EP-1244670-B1 HYDANTOIN DERIVATIVE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USING SAME MGI GP INC (US) 2006-03-08 EP disclosed
US-6974823-B2 Hydantoin derivative compounds, pharmaceutical compositions, and methods of using same GPI NIL HOLDINDGS, INC. (US) 2005-12-13 US disclosed
EP-1404325-A2 METHOD FOR TREATING NERVE INJURY CAUSED BY SURGERY GUILFORD PHARMACEUTICALS INC. (US) 2004-04-07 EP disclosed
US-20030203890-A1 Method for treating nerve injury caused as a result of surgery NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2003-10-30 US disclosed
WO-2002096420-A2 METHOD FOR TREATING NERVE INJURY CAUSED BY SURGERY GUILFORD PHARMACEUTICALS INC. (US) 2002-12-05 WO disclosed
EP-1244670-A1 HYDANTOIN DERIVATIVE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USING SAME GPI NIL Holdings, Inc. (US) 2002-10-02 EP disclosed
US-20020058685-A1 Hydantoin derivative compounds, pharmace utical compositions, and methods of using same GLIAMED, INC. 2002-05-16 US disclosed
WO-2001046195-A1 HYDANTOIN DERIVATIVE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USING SAME GPI NIL HOLDINGS, INC. (US) 2001-06-28 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-20030203890-A1 Method for treating nerve injury caused as a result of surgery NGF, BDNF, GAP43 KMT2A 4086/4885POLB 2562/4885ALDH1A1 824/4885
US-20020058685-A1 Hydantoin derivative compounds, pharmace utical compositions, and methods of using same HNMT, HAAO, HTR3E KMT2A 3409/4885POLB 3462/4885ALDH1A1 1066/4885

“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.