SCHEMBL15948921

SCHEMBL15948921

COc1ccc(F)cc1-c1ccc(CC(CC(=O)OP)NC(=O)c2n[nH]c(=O)o2)cc1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MMEL1 Q495T6 6/20 0.57
▸ MME P08473 7/20 0.41
▸ HDAC6 Q9UBN7 1/20 0.37
▸ FFAR4 Q5NUL3 1/20 0.37
▸ NR3C1 P04150 1/20 0.37
▸ PGR P06401 1/20 0.37
▸ ITGB1 P05556 1/20 0.36
▸ ITGA4 P13612 1/20 0.36
▸ CTSA P10619 3/20 0.36
▸ ROCK2 O75116 1/20 0.36
▸ ROCK1 Q13464 1/20 0.36
▸ POLB P06746 1/20 0.35
▸ KMT2A Q03164 1/20 0.35

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
SCHEMBL15947120 0.94 MMEL1 (0.60) MMEL1MMEHDAC6FFAR4NR3C1
SCHEMBL15947116 0.92 MMEL1 (0.61) MMEL1MMEHDAC6FFAR4NR3C1
SCHEMBL15947115 0.92 MMEL1 (0.61) MMEL1MMEHDAC6FFAR4NR3C1
SCHEMBL15947127 0.91 MMEL1 (0.57) MMEL1MMEHDAC6FFAR4NR3C1
SCHEMBL15939671 0.91 MMEL1 (0.69) MMEL1MMEFFAR4ITGB1ITGA4
SCHEMBL15940117 0.91 MMEL1 (0.69) MMEL1MMEFFAR4ITGB1ITGA4
SCHEMBL15948922 0.79 MMEL1 (0.59) MMEL1MMEFFAR4NR3C1PGR
SCHEMBL15940304 0.76 MMEL1 (0.60) MMEL1MMEITGB1ITGA4CTSA
SCHEMBL15940111 0.76 MMEL1 (0.60) MMEL1MMEITGB1ITGA4CTSA
SCHEMBL10197762 0.75 MMEL1 (0.54) MMEL1MMEFFAR4ITGB1ITGA4

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-9102635-B2 Substituted bisphenyl butanoic acid derivatives as NEP inhibitors with improved in vivo efficacy NOVARTIS AG (CH) 2015-08-11 — — US disclosed
WO-2014126972-A1 SUBSTITUTED BISPHENYL BUTANOIC ACID DERIVATIVES AS NEP INHIBITORS WITH IMPROVED IN VIVO EFFICACY NOVARTIS AG (CH) 2014-08-21 — — WO disclosed
US-20140228415-A1 Substituted bisphenyl butanoic acid derivatives as NEP inhibitors with improved in vivo Efficacy NOVARTIS AG (CH) 2014-08-14 — — 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-20140228415-A1 Substituted bisphenyl butanoic acid derivatives as NEP inhibitors with improved in vivo Efficacy MME, REN, ACE MMEL1 424/4885MME 1/4885HDAC6 271/4885

“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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