SCHEMBL30201327

SCHEMBL30201327

CN(C)/C=N/C(=O)c1ccc(-n2ccc3cc(C(=O)N4CCC(F)(F)CC4)cnc32)cc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HPGD P15428 8/20 0.49
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
MGLL Q99685 1/20 0.43
LRRK2 Q5S007 1/20 0.36
VNN1 O95497 1/20 0.36
ADRA1A P35348 2/20 0.35
DDR1 Q08345 3/20 0.33
GABRA5 P31644 1/20 0.33
USP1 O94782 1/20 0.32
HTR1A P08908 1/20 0.32

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
SCHEMBL31038239 1.00 HPGD (0.49) HPGDMEN1ALDH1A1KMT2ASMN1; SMN2
SCHEMBL24942619 0.91 HPGD (0.46) HPGDMEN1ALDH1A1KMT2ASMN1; SMN2
SCHEMBL31038245 0.91 HPGD (0.46) HPGDMEN1ALDH1A1KMT2ASMN1; SMN2
SCHEMBL29257192 0.91 HPGD (0.46) HPGDMEN1ALDH1A1KMT2ASMN1; SMN2
SCHEMBL23680616 0.83 HPGD (0.61) HPGDMEN1ALDH1A1KMT2AMGLL
SCHEMBL24463716 0.83 HPGD (0.56) HPGDMEN1KMT2AMGLLLRRK2
SCHEMBL23675201 0.83 HPGD (0.54) HPGDMGLLLRRK2VNN1ADRA1A
SCHEMBL23680713 0.82 HPGD (0.53) HPGDMGLLLRRK2VNN1ADRA1A
SCHEMBL30947679 0.82 HPGD (0.48) HPGDMEN1ALDH1A1KMT2ASMN1; SMN2
SCHEMBL24929883 0.82 HPGD (0.48) HPGDMEN1ALDH1A1KMT2ASMN1; SMN2

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 1/4885MEN1 3922/4885ALDH1A1 311/4885

“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.