SCHEMBL15968176

SCHEMBL15968176

O=C(O)c1cnc(OCC2CC2)c(F)c1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 7/20 0.43
FFAR4 Q5NUL3 2/20 0.43
XDH P47989 2/20 0.41
MAP4K4 O95819 1/20 0.41
KDM4C Q9H3R0 2/20 0.40
NR1H4 Q96RI1 3/20 0.39
RXRA P19793 1/20 0.39
CNR2 P34972 1/20 0.39
LRRK2 Q5S007 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
SCHEMBL15968271 0.85 CNR1 (0.43) CNR1FFAR4CNR2LRRK2
SCHEMBL15351916 0.82 DPP4 (0.50) CNR1XDHMAP4K4CNR2
SCHEMBL440247 0.82 XDH (0.41) CNR1XDHMAP4K4NR1H4RXRA
SCHEMBL15350740 0.82 XDH (0.41) CNR1XDHMAP4K4NR1H4RXRA
SCHEMBL14761488 0.81 CA2 (0.45) XDHMAP4K4CNR2
SCHEMBL411079 0.81 CNR1 (0.53) CNR1FFAR4CNR2
SCHEMBL2704405 0.80 CNR1 (0.66) CNR1FFAR4XDHMAP4K4KDM4C
SCHEMBL15968953 0.78 FFAR4 (0.48) FFAR4KDM4CNR1H4
SCHEMBL3369108 0.78 MAPT (0.50) RXRA
SCHEMBL15633550 0.78 LRRK2 (0.39) CNR1FFAR4LRRK2

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-9133129-B2 Bicyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-09-15 US disclosed
EP-2772485-A1 BICYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2014-09-03 EP disclosed
US-20140243310-A1 BICYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-08-28 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-20140243310-A1 BICYCLIC COMPOUND BICRA, NR3C2, CYP11B2 CNR1 445/4885FFAR4 3702/4885XDH 2565/4885

“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.