SCHEMBL15832201

SCHEMBL15832201

CCOC(=O)[C@H](Cc1ccc(COc2ccccc2)c(OCc2ccccc2)c1)NC(=O)NCc1ccc(N)cc1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PPID Q08752 4/20 0.52
▸ ATM Q13315 2/20 0.48
▸ L3MBTL1 Q9Y468 2/20 0.48
▸ KLKB1 P03952 3/20 0.48
▸ PPIB P23284 2/20 0.43
▸ PPIG Q13427 2/20 0.43
▸ PPARA Q07869 1/20 0.42
▸ LMNA P02545 2/20 0.41
▸ PPIA P62937 1/20 0.41
▸ LCK P06239 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 1/20 0.40

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
SCHEMBL15832199 0.93 ATM (0.57) PPIDATML3MBTL1KLKB1PPARA
SCHEMBL2034518 0.89 PPID (0.58) PPIDATML3MBTL1KLKB1PPIB
SCHEMBL12643651 0.89 PPID (0.58) PPIDATML3MBTL1KLKB1PPIB
SCHEMBL2040860 0.89 PPID (0.58) PPIDATML3MBTL1KLKB1PPIB
SCHEMBL15834863 0.86 MAPT (0.48) ATML3MBTL1KLKB1MAPTNPC1
SCHEMBL15832202 0.83 LMNA (0.48) L3MBTL1PPARALMNA
SCHEMBL12643843 0.82 ATM (0.64) PPIDATML3MBTL1KLKB1LCK
SCHEMBL14617704 0.82 ATM (0.64) PPIDATML3MBTL1KLKB1PPARA
SCHEMBL14617754 0.82 ATM (0.64) PPIDATML3MBTL1KLKB1PPARA
SCHEMBL15834851 0.81 PTPN1 (0.52) PPARA

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 2 patents. 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
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 73/4885ATM 4698/4885L3MBTL1 3342/4885

“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.

Send feedback