SCHEMBL14617704

SCHEMBL14617704

CCOC(=O)C(Cc1cccc(OCc2ccccc2)c1)NC(=O)NCc1ccc(C)cc1

nearest known ligand 0.64

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 2/20 0.64
▸ L3MBTL1 Q9Y468 1/20 0.64
▸ LMNA P02545 1/20 0.52
▸ KLKB1 P03952 2/20 0.52
▸ MME P08473 1/20 0.51
▸ ACE P12821 1/20 0.51
▸ CPA1 P15085 1/20 0.51
▸ ACE2 Q9BYF1 1/20 0.51
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ GPR132 Q9UNW8 1/20 0.47
▸ PPID Q08752 1/20 0.47
▸ LCK P06239 1/20 0.46
▸ ITGB3 P05106 1/20 0.46
▸ ITGAV P06756 1/20 0.46
▸ ANPEP P15144 2/20 0.46
▸ PPARA Q07869 1/20 0.45
▸ POLB P06746 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ MAOB P27338 1/20 0.45

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
SCHEMBL14617757 0.95 ATM (0.65) ATML3MBTL1LMNAKLKB1MME
SCHEMBL2034518 0.92 PPID (0.58) ATML3MBTL1KLKB1MMEACE
SCHEMBL15832199 0.89 ATM (0.57) ATML3MBTL1LMNAKLKB1SMN1; SMN2
SCHEMBL14617754 0.88 ATM (0.64) ATML3MBTL1LMNAKLKB1SMN1; SMN2
SCHEMBL2053665 0.86 MAPT (0.51) ATML3MBTL1KLKB1MMEACE
SCHEMBL16270324 0.86 ATM (0.65) ATML3MBTL1KLKB1SMN1; SMN2PPID
SCHEMBL12643843 0.84 ATM (0.64) ATML3MBTL1KLKB1MMEACE
SCHEMBL15832201 0.82 PPID (0.52) ATML3MBTL1LMNAKLKB1PPID
SCHEMBL2563776 0.82 ATM (0.80) ATML3MBTL1KLKB1PPIDANPEP
SCHEMBL14617709 0.81 MME (0.57) L3MBTL1LMNAMMEACECPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8901295-B2 Inhibitors of cyclophilins and uses thereof INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2014-12-02 — — US disclosed
US-8901295-B2 Inhibitors of cyclophilins and uses thereof INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2014-12-02 — — US disclosed
US-8802666-B2 Inhibitors of cyclophilins and uses thereof INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2014-08-12 — — US disclosed
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
US-20130018044-A1 NEW INHIBITORS OF CYCLOPHILINS AND USES THEREOF INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2013-01-17 — — 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 (2 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 ATM 4698/4885L3MBTL1 3342/4885LMNA 4126/4885
US-20130018044-A1 NEW INHIBITORS OF CYCLOPHILINS AND USES THEREOF FKBP3, FKBP4, FKBP5 ATM 4698/4885L3MBTL1 3342/4885LMNA 4126/4885

“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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