SCHEMBL2180711

SCHEMBL2180711

CCOC(=O)CNC(=O)C1CCCN1C(=O)Cc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.52
CYP2C9 P11712 1/20 0.52
PKM P14618 1/20 0.52
CYP2C19 P33261 1/20 0.52
ITGB1 P05556 4/20 0.50
ITGA4 P13612 4/20 0.50
FAP Q12884 1/20 0.49
L3MBTL1 Q9Y468 2/20 0.48
LTA4H P09960 1/20 0.48
FKBP1A P62942 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
TSHR P16473 1/20 0.48
KMT2A Q03164 1/20 0.48
KDM4E B2RXH2 1/20 0.48
LMNA P02545 1/20 0.48
PPID Q08752 1/20 0.47
PRCP P42785 1/20 0.47
F2 P00734 1/20 0.47
NPC1 O15118 1/20 0.47

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
SCHEMBL23659223 1.00 CYP3A4 (0.52) CYP3A4CYP2C9PKMCYP2C19ITGB1
SCHEMBL194807 1.00 CYP3A4 (0.52) CYP3A4CYP2C9PKMCYP2C19ITGB1
SCHEMBL9545364 0.88 FKBP1A (0.55) CYP3A4CYP2C9PKMCYP2C19L3MBTL1
SCHEMBL194738 0.85 ITGB1 (0.53) CYP3A4CYP2C9PKMCYP2C19ITGB1
SCHEMBL6351617 0.85 ITGB1 (0.53) CYP3A4CYP2C9PKMCYP2C19ITGB1
SCHEMBL10456661 0.85 PRCP (0.61) CYP3A4CYP2C9L3MBTL1SMN1; SMN2TSHR
SCHEMBL6354036 0.84 CYP3A4 (0.51) CYP3A4CYP2C9PKMCYP2C19ITGB1
SCHEMBL6357029 0.84 ALDH1A1 (0.52) CYP3A4CYP2C9PKMCYP2C19FAP
SCHEMBL6351647 0.83 CYP3A4 (0.52) CYP3A4CYP2C9PKMCYP2C19ITGB1
SCHEMBL9545156 0.83 ALDH1A1 (0.51) CYP3A4CYP2C9PKMCYP2C19ITGB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190070251-A1 POLYMER CONJUGATES OF THERAPEUTIC PEPTIDES NEKTAR THERAPEUTICS 2019-03-07 US disclosed
US-9682153-B2 Polymer conjugates of therapeutic peptides NEKTAR THERAPEUTICS (US) 2017-06-20 US disclosed
US-20160022828-A1 POLYMER CONJUGATES OF THERAPEUTIC PEPTIDES NEKTAR THERAPEUTICS 2016-01-28 US disclosed
US-9173951-B2 Carbohydrate-based drug delivery polymers and conjugates thereof NEKTAR THERAPEUTICS (US) 2015-11-03 US disclosed
US-20150051371-A1 CARBOHYDRATE-BASED DRUG DELIVERY POLYMERS AND CONJUGATES THEREOF NEKTAR THERAPEUTICS (US) 2015-02-19 US disclosed
US-8680263-B2 Carbohydrate-based drug delivery polymers and conjugates thereof NEKTAR THERAPEUTICS (US) 2014-03-25 US disclosed
US-20110171716-A1 CARBOHYDRATE-BASED DRUG DELIVERY POLYMERS AND CONJUGATES THEREOF NEKTAR THERAPEUTICS (US) 2011-07-14 US disclosed
US-20110171312-A1 MODIFIED THERAPEUTIC PEPTIDES, METHODS OF THEIR PREPARATION AND USE NEKTAR THERAPEUTICS (US) 2011-07-14 US disclosed
US-20110166063-A1 POLYMER CONJUGATES OF THERAPEUTIC PEPTIDES NEKTAR THERAPEUTICS (US) 2011-07-07 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 (6 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-20160022828-A1 POLYMER CONJUGATES OF THERAPEUTIC PEPTIDES NGLY1, CD44, IAPP CYP3A4 4045/4885CYP2C9 4247/4885PKM 3973/4885
US-20110171716-A1 CARBOHYDRATE-BASED DRUG DELIVERY POLYMERS AND CONJUGATES THEREOF STT3B, STT3A, DDOST CYP3A4 1172/4885CYP2C9 1263/4885PKM 542/4885
US-20150051371-A1 CARBOHYDRATE-BASED DRUG DELIVERY POLYMERS AND CONJUGATES THEREOF STT3B, STT3A, DDOST CYP3A4 1172/4885CYP2C9 1263/4885PKM 542/4885
US-20110166063-A1 POLYMER CONJUGATES OF THERAPEUTIC PEPTIDES NGLY1, CD44, IAPP CYP3A4 4045/4885CYP2C9 4247/4885PKM 3973/4885
US-20190070251-A1 POLYMER CONJUGATES OF THERAPEUTIC PEPTIDES NGLY1, CD44, IAPP CYP3A4 4045/4885CYP2C9 4247/4885PKM 3973/4885
US-20110171312-A1 MODIFIED THERAPEUTIC PEPTIDES, METHODS OF THEIR PREPARATION AND USE DNPEP, VIP, PTMS CYP3A4 4751/4885CYP2C9 4224/4885PKM 3445/4885

“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.