SCHEMBL7872292

SCHEMBL7872292

Cc1cn2c(CNCCCCNS(=O)(=O)C(F)(F)F)cccc2n1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.37
NPY5R Q15761 1/20 0.35
IDO1 P14902 1/20 0.32
CNR1 P21554 1/20 0.32
CNR2 P34972 1/20 0.32
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
SLC2A1 P11166 1/20 0.30
PPARA Q07869 1/20 0.30
MALT1 Q9UDY8 1/20 0.30
EGLN1 Q9GZT9 1/20 0.30

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
SCHEMBL7871683 0.86 EPHX1 (0.40) EPHX1NPY5RIDO1CNR1CNR2
SCHEMBL7870267 0.83 NPY5R (0.39) EPHX1NPY5RIDO1CNR1CNR2
SCHEMBL7863546 0.80 NPY5R (0.39) EPHX1NPY5RIDO1CNR1CNR2
SCHEMBL7872382 0.79 NPY5R (0.40) EPHX1NPY5RIDO1CNR1CNR2
SCHEMBL7863412 0.78 NPY5R (0.36) EPHX1NPY5RIDO1CNR1CNR2
SCHEMBL7871566 0.77 CA14 (0.35) IDO1CNR1CNR2
SCHEMBL7868751 0.76 CA14 (0.35) EPHX1NPY5R
SCHEMBL8908698 0.72 EPHX1 (0.32) EPHX1NPY5RIDO1CNR1CNR2
SCHEMBL7863518 0.67 EPHX1 (0.36) EPHX1NPY5RIDO1CNR1CNR2
Hydrochloric Acid SCHEMBL7871619 0.66 EPHX1 (0.36) EPHX1NPY5RIDO1CNR1CNR2

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-20010051631-A1 Tricyclic compounds, their production and use TAKATANI MUNEO (JP) 2001-12-13 US disclosed
US-6251905-B1 Tricyclic compounds, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-06-26 US disclosed
EP-0771319-A1 TRICYCLIC COMPOUNDS, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1997-05-07 EP disclosed
WO-1996002542-A1 TRICYCLIC COMPOUNDS, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-02-01 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-20010051631-A1 Tricyclic compounds, their production and use PDGFA, HGF, REN EPHX1 393/4885NPY5R 1237/4885IDO1 795/4885

“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.