SCHEMBL16268486

SCHEMBL16268486

CCOC(=O)c1nc(Br)n(C2CC2)c1C(=O)OCC

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GRK6 P43250 1/20 0.42
OGFRL1 Q5TC84 4/20 0.39
OPRM1 P35372 3/20 0.39
OPRK1 P41145 3/20 0.39
OPRD1 P41143 2/20 0.39
TARBP2 Q15633 1/20 0.36
ALDH1A1 P00352 3/20 0.36
CYP1A2 P05177 1/20 0.36
MAPK1 P28482 2/20 0.36
KMT2A Q03164 2/20 0.36
KDM4E B2RXH2 1/20 0.36
HPGD P15428 1/20 0.36
HSD17B10 Q99714 1/20 0.36
USP2 O75604 1/20 0.35
TP53 P04637 1/20 0.35
ALOX12 P18054 1/20 0.35
ELANE P08246 2/20 0.35
MAPT P10636 1/20 0.35
TSHR P16473 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
SCHEMBL16268413 0.83 GRK6 (0.40) GRK6OGFRL1OPRM1OPRK1OPRD1
SCHEMBL8278554 0.77 ALDH1A1 (0.41) TARBP2ALDH1A1CYP1A2MAPK1KMT2A
SCHEMBL8048488 0.77 OGFRL1 (0.47) GRK6OGFRL1OPRM1OPRK1OPRD1
SCHEMBL5038584 0.75 GRK6 (0.44) GRK6OGFRL1OPRM1OPRK1OPRD1
SCHEMBL16268945 0.74 CYP2C19 (0.39) GRK6TARBP2CYP1A2KMT2AKDM4E
SCHEMBL15145571 0.73 TARBP2 (0.40) GRK6OGFRL1OPRM1OPRK1OPRD1
SCHEMBL30668018 0.72 GRK6 (0.43) GRK6OGFRL1OPRM1OPRK1OPRD1
SCHEMBL3198143 0.70 KDM4E (0.36) TARBP2ALDH1A1CYP1A2MAPK1KMT2A
SCHEMBL16268118 0.70 ALDH1A1 (0.42) ALDH1A1KMT2AKDM4EHPGDHSD17B10
SCHEMBL2681871 0.70 CNR2 (0.50) GRK6OGFRL1OPRM1OPRK1OPRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3412675-A1 IMIDAZOPYRROLIDINONE DERIVATIVES AND THEIR USE IN THE TREATMENT OF DISEASE Novartis AG (CH) 2018-12-12 EP disclosed
US-9890166-B2 Imidazopyrrolidine derivatives and their use in the treatment of disease NOVARTIS AG (CH) 2018-02-13 US disclosed
US-9890166-B2 Imidazopyrrolidine derivatives and their use in the treatment of disease NOVARTIS AG (CH) 2018-02-13 US disclosed
US-9890166-B2 Imidazopyrrolidine derivatives and their use in the treatment of disease NOVARTIS AG (CH) 2018-02-13 US disclosed
US-20160108047-A1 IMIDAZOPYRROLIDINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF DISEASE NOVARTIS AG (CH) 2016-04-21 US disclosed
US-20160108047-A1 IMIDAZOPYRROLIDINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF DISEASE NOVARTIS AG (CH) 2016-04-21 US disclosed
US-20160108047-A1 IMIDAZOPYRROLIDINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF DISEASE NOVARTIS AG (CH) 2016-04-21 US disclosed
EP-3004109-A1 IMIDAZOPYRROLIDINONE DERIVATIVES AND THEIR USE IN THE TREATMENT OF DISEASE Novartis AG (CH) 2016-04-13 EP disclosed
WO-2014191894-A1 IMIDAZOPYRROLIDINONE DERIVATIVES AND THEIR USE IN THE TREATMENT OF DISEASE NOVARTIS AG (CH) 2014-12-04 WO disclosed
WO-2014191894-A1 IMIDAZOPYRROLIDINONE DERIVATIVES AND THEIR USE IN THE TREATMENT OF DISEASE NOVARTIS AG (CH) 2014-12-04 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-20160108047-A1 IMIDAZOPYRROLIDINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF DISEASE TPMT, REN, IL5 GRK6 2597/4885OGFRL1 3679/4885OPRM1 2088/4885

“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.