SCHEMBL30201254

SCHEMBL30201254

CC1CN(C(=O)c2cnc3c(ccn3-c3ccc(-c4nc(N)n[nH]4)nc3)c2)CCO1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.40
MGLL Q99685 1/20 0.37
VNN1 O95497 2/20 0.35
GLRA1 P23415 1/20 0.35
DGAT1 O75907 4/20 0.34
NTRK1 P04629 2/20 0.33
ALK Q9UM73 2/20 0.33
PTK2 Q05397 1/20 0.33
GHSR Q92847 2/20 0.33
MAP3K12 Q12852 1/20 0.31
MAP3K14 Q99558 1/20 0.31
SYK P43405 1/20 0.31

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
SCHEMBL24942783 1.00 HPGD (0.40) HPGDMGLLVNN1GLRA1DGAT1
SCHEMBL30201388 0.87 HPGD (0.41) HPGDMGLLVNN1GLRA1DGAT1
SCHEMBL30201633 0.81 HPGD (0.45) HPGDMGLLVNN1GLRA1DGAT1
SCHEMBL30201361 0.79 HPGD (0.44) HPGDMGLLVNN1GLRA1DGAT1
SCHEMBL30202213 0.79 HPGD (0.42) HPGDMGLLVNN1GLRA1DGAT1
SCHEMBL30201178 0.78 HPGD (0.42) HPGDMGLLVNN1
SCHEMBL29257202 0.77 HPGD (0.55) HPGDMGLLVNN1GLRA1
SCHEMBL24942867 0.77 HPGD (0.55) HPGDMGLLVNN1GLRA1
SCHEMBL24942672 0.77 HPGD (0.42) HPGDMGLLGHSR
SCHEMBL24942703 0.76 HPGD (0.42) HPGDMGLLVNN1GLRA1NTRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240294519-A1 PYRROLO[2,3-b]PYRIDINE PGDH INHIBITORS AND METHODS OF MAKING AND USING EPIRIUM BIO INC. 2024-09-05 US disclosed
CN-118338902-A Pyrrolo [2,3-b ] pyridine PGDH inhibitors and methods of making and using the same 埃皮里姆生物股份有限公司 2024-07-12 CN disclosed
EP-4376841-A1 PYRROLO[2,3-B]PYRIDINE PGDH INHIBITORS AND METHODS OF MAKING AND USING Epirium Bio Inc. (US) 2024-06-05 EP disclosed
WO-2023009642-A1 PYRROLO[2,3-B]PYRIDINE PGDH INHIBITORS AND METHODS OF MAKING AND USING EPIRIUM BIO INC. (US) 2023-02-02 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-20240294519-A1 PYRROLO[2,3-b]PYRIDINE PGDH INHIBITORS AND METHODS OF MAKING AND USING HPGD, HPGDS, PTGIS HPGD 1/4885MGLL 1025/4885VNN1 596/4885

“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.