SCHEMBL30201388

SCHEMBL30201388

CC1CN(C(=O)c2cnc3c(ccn3-c3ccc(-c4ncn[nH]4)nc3)c2)CCO1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.41
VNN1 O95497 2/20 0.38
MGLL Q99685 1/20 0.38
GLRA1 P23415 1/20 0.36
EGLN1 Q9GZT9 1/20 0.34
CXCR3 P49682 1/20 0.34
DGAT1 O75907 1/20 0.33
NTRK1 P04629 2/20 0.33
ALK Q9UM73 2/20 0.33
PTK2 Q05397 1/20 0.33
PDE2A O00408 3/20 0.32
HRH3 Q9Y5N1 1/20 0.32
GHSR Q92847 1/20 0.32
HCRTR1 O43613 1/20 0.32
HCRTR2 O43614 1/20 0.32
SYK P43405 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
DDR1 Q08345 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
SCHEMBL30201178 0.92 HPGD (0.42) HPGDVNN1MGLLEGLN1NPSR1
SCHEMBL24942672 0.90 HPGD (0.42) HPGDMGLLCXCR3GHSRHCRTR1
SCHEMBL30201254 0.87 HPGD (0.40) HPGDVNN1MGLLGLRA1DGAT1
SCHEMBL24942783 0.87 HPGD (0.40) HPGDVNN1MGLLGLRA1DGAT1
SCHEMBL24942782 0.86 HPGD (0.44) HPGDVNN1MGLLEGLN1CXCR3
SCHEMBL24942671 0.85 HPGD (0.47) HPGDVNN1MGLLNTRK1DDR1
SCHEMBL24942785 0.85 HPGD (0.41) HPGDVNN1MGLLCXCR3HCRTR1
SCHEMBL24942242 0.84 HPGD (0.58) HPGDMGLLEGLN1DDR1
SCHEMBL24942662 0.84 HPGD (0.47) HPGDVNN1MGLLEGLN1DDR1
SCHEMBL24942663 0.83 HPGD (0.43) HPGDVNN1MGLLDDR1

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 1/4885VNN1 596/4885MGLL 1025/4885

“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.