SCHEMBL5116887

SCHEMBL5116887

CCOC(OCC)c1ccc2ccccc2n1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.45
HSD17B10 Q99714 1/20 0.45
KMT2A Q03164 3/20 0.43
MEN1 O00255 1/20 0.43
PRNP P04156 1/20 0.43
CYP1A2 P05177 2/20 0.42
NCF1 P14598 3/20 0.40
TLR8 Q9NR97 1/20 0.39
CYSLTR1 Q9Y271 2/20 0.39
GPBAR1 Q8TDU6 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
NOS2 P35228 1/20 0.38
BACE1 P56817 1/20 0.38
CA12 O43570 1/20 0.38
CA9 Q16790 1/20 0.38
HPGD P15428 2/20 0.38
MGAM O43451 1/20 0.38
HRH3 Q9Y5N1 1/20 0.38
GAA P10253 2/20 0.38
CYSLTR2 Q9NS75 1/20 0.38

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
SCHEMBL27858097 0.81 ALDH1A1 (0.44) ALDH1A1HSD17B10KMT2AMEN1PRNP
SCHEMBL4741484 0.79 CYP1A2 (0.47) ALDH1A1HSD17B10KMT2APRNPCYP1A2
SCHEMBL6798817 0.76 ALDH1A1 (0.49) ALDH1A1HSD17B10PRNPCYP1A2NCF1
SCHEMBL22288126 0.76 ALDH1A1 (0.49) ALDH1A1HSD17B10KMT2AMEN1CYP1A2
SCHEMBL28533930 0.74 KMT2A (0.50) ALDH1A1HSD17B10KMT2AMEN1PRNP
SCHEMBL5573487 0.74 ALDH1A1 (0.47) ALDH1A1HSD17B10PRNPCYP1A2NCF1
SCHEMBL9682782 0.74 ALDH1A1 (0.48) ALDH1A1HSD17B10KMT2AMEN1PRNP
SCHEMBL6848182 0.73 ALDH1A1 (0.62) ALDH1A1HSD17B10KMT2AMEN1PRNP
SCHEMBL1039380 0.73 ALDH1A1 (0.46) ALDH1A1HSD17B10KMT2AMEN1CYP1A2
SCHEMBL10518600 0.73 ALDH1A1 (0.46) ALDH1A1HSD17B10CYP1A2NCF1CYSLTR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7407969-B2 Respiratory syncytial virus replication inhibitors JANSSEN PHARMACEUTICA, N.V. (BE) 2008-08-05 US disclosed
EP-1400519-B1 Respiratory syncytial virus replication inhibitors JANSSEN PHARMACEUTICA NV (BE) 2007-03-07 EP disclosed
US-7071192-B1 Respiratory syncytial virus replication inhibitors JANSSEN PHARMACEUTICA, N.V. (BE) 2006-07-04 US disclosed
US-20060058309-A1 Respiratory syncytial virus replication inhibitors JANSSEN PHARMACEUTICA, N.V. (BE) 2006-03-16 US disclosed
CN-1171887-C Respiratory syncytial virus replication inhibitors ղɭҩҵ���޹�˾ 2004-10-20 CN disclosed
EP-1400519-A1 Respiratory syncytial virus replication inhibitors JANSSEN PHARMACEUTICA N.V. (BE) 2004-03-24 EP disclosed
EP-1196410-B1 RESPIRATORY SYNCYTIAL VIRUS REPLICATION INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2004-02-18 EP disclosed
CN-1358182-A Respiratory syncytial virus replication inhibitors JANSSEN PHARMACEUTICA NV (BE) 2002-07-10 CN disclosed
EP-1196410-A1 RESPIRATORY SYNCYTIAL VIRUS REPLICATION INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2002-04-17 EP disclosed
WO-2001000615-A1 RESPIRATORY SYNCYTIAL VIRUS REPLICATION INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2001-01-04 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 (1 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-20060058309-A1 Respiratory syncytial virus replication inhibitors NR4A1, NR4A3, NR4A2 ALDH1A1 2521/4885HSD17B10 1617/4885KMT2A 1494/4885

“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.