SCHEMBL4495623

SCHEMBL4495623

CC(C)(C)OC(=O)C(Nc1nc2c(C(=O)O)cccc2[nH]1)C1CCNCC1

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.42
PARP1 P09874 17/20 0.41
KDM4E B2RXH2 1/20 0.40
HPGD P15428 1/20 0.40
PARP2 Q9UGN5 1/20 0.39
DHODH Q02127 1/20 0.37

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
SCHEMBL4503785 0.91 RIPK1 (0.53) RIPK1PARP1PARP2
SCHEMBL7797107 0.76 NPR3 (0.42)
SCHEMBL4496639 0.72 SMYD3 (0.39) KDM4EHPGD
SCHEMBL4516401 0.72 PARP1 (0.48) RIPK1PARP1KDM4EHPGDPARP2
SCHEMBL4503916 0.70 COASY (0.39) RIPK1PARP1KDM4EHPGDPARP2
SCHEMBL4495617 0.70 PARP1 (0.56) PARP1KDM4E
SCHEMBL4506124 0.70 MEN1 (0.39) RIPK1PARP1KDM4EHPGDPARP2
SCHEMBL8703070 0.69 ITGA4 (0.42)
SCHEMBL5620711 0.68 PARP1 (0.79) PARP1PARP2
SCHEMBL7298273 0.67 MMP1 (0.36)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7517875-B2 Piperidine derivatives having CCR3 antagonism TEIJIN LIMITED (JP) 2009-04-14 US disclosed
US-20070032525-A1 Piperidine derivatives having ccr3 antagonism TEIJIN LIMITED, A JAPANESE BODY CORPORATE (JP) 2007-02-08 US disclosed
EP-1502916-A1 PIPERIDINE DERIVATIVES HAVING CCR3 ANTAGONISM TEIJIN LIMITED (JP) 2005-02-02 EP 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-20070032525-A1 Piperidine derivatives having ccr3 antagonism CCR3, CCR1, CCR4 RIPK1 1974/4885PARP1 972/4885KDM4E 3395/4885

“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.