SCHEMBL18610482

SCHEMBL18610482

CCC(=N)Oc1cc(C(=O)C2=C(O)C(=O)N(C)C2)oc1Cc1ccc(F)cc1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 15/20 0.43
LIPC P11150 1/20 0.33
GPR55 Q9Y2T6 2/20 0.33
CNR2 P34972 1/20 0.32
BRAF P15056 1/20 0.32
MAP2K1 Q02750 1/20 0.32
HSP90AA1 P07900 1/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL14259602 0.81 LIPG (0.47) LIPGLIPCGPR55CNR2
SCHEMBL755390 0.80 LIPG (0.46) LIPGLIPC
SCHEMBL754651 0.80 LIPG (0.45) LIPGMAPT
SCHEMBL754957 0.78 LIPG (0.49) LIPGLIPC
SCHEMBL752899 0.75 LIPG (0.51) LIPGLIPC
SCHEMBL6811177 0.73 LIPG (0.55) LIPGMAPT
SCHEMBL754256 0.73 LIPG (0.49) LIPGLIPC
SCHEMBL2777764 0.72 LIPG (0.48) LIPGLIPC
SCHEMBL752680 0.72 LIPG (0.46) LIPGLIPC
SCHEMBL2778238 0.72 LIPG (0.47) LIPGLIPC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170066754-A1 ANTIVIRAL AGENT SHIONOGI & CO., LTD. (JP) 2017-03-09 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-20170066754-A1 ANTIVIRAL AGENT ZC3HAV1, ZC3HAV1L, CCNI LIPG 4229/4885LIPC 3817/4885GPR55 2647/4885

“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.