SCHEMBL15832192

SCHEMBL15832192

C=C1c2ccccc2C(=C)C1CC1CCCN(C(=O)CNC(=O)NCc2ccc(N)cc2)C1

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PPID Q08752 13/20 0.58
▸ PPIB P23284 7/20 0.56
▸ PPIG Q13427 7/20 0.50
▸ EPHX2 P34913 1/20 0.40
▸ EPHX1 P07099 1/20 0.40
▸ LMNA P02545 1/20 0.39

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
SCHEMBL2039280 0.78 PPID (0.73) PPIDPPIBPPIGEPHX1
SCHEMBL12643750 0.76 PPIB (0.73) PPIDPPIBPPIGEPHX1
SCHEMBL2037719 0.75 PPID (1.00) PPIDPPIBPPIGEPHX1
SCHEMBL2053173 0.74 PPID (0.97) PPIDPPIBPPIGEPHX1
SCHEMBL2036896 0.72 PPIB (1.00) PPIDPPIBPPIG
SCHEMBL2037683 0.71 PPID (0.76) PPIDPPIBPPIGEPHX1
SCHEMBL2035627 0.69 PPIB (1.00) PPIDPPIBPPIG
SCHEMBL28056208 0.68 PPID (0.81) PPIDPPIBPPIG
SCHEMBL14617668 0.68 PPIB (0.59) PPIDPPIBPPIGEPHX2
SCHEMBL2038271 0.68 PPID (0.78) PPIDPPIBPPIGEPHX1

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-20140179687-A1 New Inhibitors of Cyclophilins and Uses Thereof INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2014-06-26 — — 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-20140179687-A1 New Inhibitors of Cyclophilins and Uses Thereof FKBP3, FKBP4, FKBP5 PPID 73/4885PPIB 51/4885PPIG 28/4885

“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.

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