SCHEMBL4523921

SCHEMBL4523921

COC1CN(Cc2ncc[nH]2)C1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.59
OPRM1 P35372 1/20 0.45
KAT2B Q92831 1/20 0.38
CD274 Q9NZQ7 6/20 0.37
PDCD1 Q15116 5/20 0.37
HTR4 Q13639 1/20 0.37
LTA4H P09960 1/20 0.37
KDM4E B2RXH2 2/20 0.36
MAPT P10636 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
TAAR1 Q96RJ0 3/20 0.36
ALDH1A1 P00352 2/20 0.35
PARP1 P09874 1/20 0.35
LMNA P02545 1/20 0.35
TLR7 Q9NYK1 1/20 0.35
BACE1 P56817 1/20 0.35
PDCD1LG2 Q9BQ51 1/20 0.34

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
SCHEMBL2295430 0.78 ALOX15 (0.65) ALOX15OPRM1KAT2BCD274PDCD1
SCHEMBL17887924 0.75 ALOX15 (0.61) ALOX15OPRM1KAT2BHTR4KDM4E
SCHEMBL15329166 0.75 ALOX15 (1.00) ALOX15KAT2BHTR4KDM4ETAAR1
SCHEMBL17887877 0.75 TAAR1 (0.45) ALOX15OPRM1KAT2BKDM4EMAPT
SCHEMBL14197731 0.73 ALOX15 (0.62) ALOX15OPRM1KAT2BHTR4KDM4E
SCHEMBL14375217 0.72 ALOX15 (0.71) ALOX15OPRM1KAT2BHTR4KDM4E
SCHEMBL4515060 0.72 ALOX15 (0.85) ALOX15OPRM1KAT2BKDM4EMAPT
SCHEMBL1953418 0.72 ALOX15 (0.85) ALOX15KAT2BKDM4EMAPTTDP1
SCHEMBL5151262 0.71 ALOX15 (0.82) ALOX15KAT2BHTR4KDM4EMAPT
SCHEMBL4498933 0.71 ALOX15 (0.64) ALOX15OPRM1KAT2BHTR4KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7482374-B2 Pyrrolidine-2-ones as Factor Xa inhibitors GLAXO GROUP LIMITED (GB) 2009-01-27 US disclosed
US-7482374-B2 Pyrrolidine-2-ones as Factor Xa inhibitors GLAXO GROUP LIMITED (GB) 2009-01-27 US disclosed
US-7482374-B2 Pyrrolidine-2-ones as Factor Xa inhibitors GLAXO GROUP LIMITED (GB) 2009-01-27 US disclosed
US-20060167079-A1 Pyrrolidine -2-ones as factor xa inhibitors GLAXO GROUP LIMITED (GB) 2006-07-27 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 (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-20060167079-A1 Pyrrolidine -2-ones as factor xa inhibitors TFPI, F2, F11 ALOX15 1843/4885OPRM1 1461/4885KAT2B 1623/4885

“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.