SCHEMBL2176387

SCHEMBL2176387

CCOC(=O)C(=O)NCCNC(=O)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 2/20 0.62
SMN1; SMN2 Q16637 4/20 0.40
ALDH1A1 P00352 4/20 0.40
CYP2D6 P10635 1/20 0.40
GAA P10253 5/20 0.40
MAPT P10636 1/20 0.40
HTT P42858 1/20 0.40
MGAM O43451 1/20 0.39
SI P14410 1/20 0.39
MGAM2 Q2M2H8 1/20 0.39
CYP19A1 P11511 2/20 0.39
GPR35 Q9HC97 2/20 0.39
TDP1 Q9NUW8 2/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
PKM P14618 1/20 0.38
KDM4E B2RXH2 1/20 0.38

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
SCHEMBL2177369 0.94 EGLN1 (0.60) EGLN1SMN1; SMN2ALDH1A1CYP2D6GAA
SCHEMBL2180162 0.92 EGLN1 (0.58) EGLN1KDM4E
SCHEMBL12495312 0.91 EGLN1 (0.65) EGLN1SMN1; SMN2ALDH1A1CYP2D6GAA
SCHEMBL13552393 0.85 EGLN1 (0.63) EGLN1SMN1; SMN2ALDH1A1GAAMAPT
SCHEMBL24873009 0.83 EGLN1 (0.61) EGLN1SMN1; SMN2ALDH1A1GAAMAPT
SCHEMBL2032859 0.83 EGLN1 (0.61) EGLN1KDM4E
SCHEMBL11596790 0.83 EGLN1 (0.61) EGLN1KDM4E
SCHEMBL1912783 0.81 EGLN1 (0.59) EGLN1
SCHEMBL8823519 0.81 EGLN1 (0.59) EGLN1SMN1; SMN2ALDH1A1GAAMAPT
SCHEMBL29052443 0.81 EGLN1 (0.46) EGLN1SMN1; SMN2ALDH1A1CYP2D6GAA

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-8765881-B2 Methods of making polydiorganosiloxane polyoxamide copolymers 3M INNOVATIVE PROPERTIES COMPANY (US) 2014-07-01 US disclosed
EP-2519563-B1 METHODS OF MAKING POLYDIORGANOSILOXANE POLYOXAMIDE COPOLYMERS 3M INNOVATIVE PROPERTIES CO (US) 2013-11-06 EP disclosed
EP-2519563-A1 METHODS OF MAKING POLYDIORGANOSILOXANE POLYOXAMIDE COPOLYMERS 3M Innovative Properties Company (US) 2012-11-07 EP disclosed
US-20120271025-A1 METHODS OF MAKING POLYDIORGANOSILOXANE POLYOXAMIDE COPOLYMERS 3M INNOVATIVE PROPERTIES COMPANY (US) 2012-10-25 US disclosed
WO-2011082069-A1 METHODS OF MAKING POLYDIORGANOSILOXANE POLYOXAMIDE COPOLYMERS 3M INNOVATIVE PROPERTIES COMPANY (US) 2011-07-07 WO 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-20120271025-A1 METHODS OF MAKING POLYDIORGANOSILOXANE POLYOXAMIDE COPOLYMERS PPOX, PARG, PAM EGLN1 322/4885SMN1; SMN2 2029/4885ALDH1A1 2672/4885

“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.