SCHEMBL1669858

SCHEMBL1669858

CCCCCCCCCCCCCCCC(O)c1nc(CC(=O)OCC)cs1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
MAPK1 P28482 2/20 0.53
TSHR P16473 2/20 0.53
GAA P10253 1/20 0.50
POLB P06746 1/20 0.49
LMNA P02545 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.47
ALDH1A1 P00352 2/20 0.46
MAPT P10636 2/20 0.45
HTT P42858 2/20 0.45
TP53 P04637 1/20 0.44
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43

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
SCHEMBL20662502 0.99 MEN1 (0.56) MEN1KMT2AMAPK1TSHRGAA
SCHEMBL15924576 0.87 MAPK1 (0.51) MEN1KMT2AMAPK1TSHRGAA
SCHEMBL12548974 0.85 MEN1 (0.62) MEN1KMT2AMAPK1TSHRGAA
SCHEMBL1667486 0.84 LMNA (0.49) MEN1KMT2APOLBLMNASMN1; SMN2
SCHEMBL15921148 0.81 PLA2G4A (0.49) MEN1KMT2AMAPK1TSHRGAA
SCHEMBL5515633 0.80 MEN1 (0.65) MEN1KMT2AMAPK1TSHRGAA
SCHEMBL1667066 0.80 RAB9A (0.51) MEN1KMT2AMAPK1GAAPOLB
SCHEMBL18649492 0.78 MEN1 (0.59) MEN1KMT2AMAPK1TSHRGAA
SCHEMBL27868016 0.78 MAPK1 (0.56) MEN1KMT2AMAPK1TSHRGAA
SCHEMBL7508636 0.78 MAPK1 (0.56) MEN1KMT2AMAPK1TSHRGAA

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
US-10370344-B2 2-oxothiazole compounds and method of using same for chronic inflammatory disorders AVEXXIN AS (NO) 2019-08-06 US disclosed
EP-3431084-A1 ANTIINFLAMMATORY 2-OXOTHIAZOLES Avexxin AS (NO) 2019-01-23 EP disclosed
US-20170166539-A1 COMPOUND AVEXXIN AS (NO) 2017-06-15 US disclosed
US-9597318-B2 2-oxothiazole compounds and method of using same for chronic inflammatory disorders AVEXXIN AS (NO) 2017-03-21 US disclosed
CN-103772312-A ANTI INFLAMMATORY 2-OXOTHIAZOLES AND 2 -OXOOXAZOLES AVEXXIN AS 2014-05-07 CN disclosed
CN-102647984-A Anti-inflammatory 2-carbonylthiazoles and 2-carbonyloxazoles AVEXXIN AS 2012-08-22 CN disclosed
EP-2482815-A1 ANTI INFLAMMATORY 2-OXOTHIAZOLES AND 2 -OXOOXAZOLES Avexxin AS (NO) 2012-08-08 EP disclosed
US-20110136879-A1 COMPOUND AVEXXIN AS (NO) 2011-06-09 US disclosed
WO-2011039365-A1 ANTI INFLAMMATORY 2-OXOTHIAZOLES AND 2 -OXOOXAZOLES AVEXXIN AS (NO) 2011-04-07 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 (3 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-20110136879-A1 COMPOUND CBR1, CBR3, CCR1 MEN1 2321/4885KMT2A 4796/4885MAPK1 1237/4885
US-20170166539-A1 COMPOUND CBR1, CBR3, CCR1 MEN1 2314/4885KMT2A 4797/4885MAPK1 1246/4885
US-10370344-B2 2-oxothiazole compounds and method of using same for chronic inflammatory disorders CX3CR1, LTC4S, CBR1 MEN1 3221/4885KMT2A 4706/4885MAPK1 2287/4885

“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.