SCHEMBL30201678

SCHEMBL30201678

O=C(c1cnc2c(ccn2-c2ccc(-c3nc[nH]n3)cn2)c1)N1CCC(F)(F)CC1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.47
MGLL Q99685 4/20 0.38
ROCK2 O75116 3/20 0.37
ROCK1 Q13464 2/20 0.37
ADRA1A P35348 1/20 0.37
DDR1 Q08345 2/20 0.34
VNN1 O95497 1/20 0.34
GABRA5 P31644 1/20 0.33
LRRK2 Q5S007 1/20 0.33
USP1 O94782 1/20 0.33
CCNC P24863 1/20 0.33
CDK8 P49336 1/20 0.33

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
SCHEMBL23675126 0.85 HPGD (0.46) HPGDMGLLROCK2ROCK1ADRA1A
SCHEMBL30201450 0.85 HPGD (0.55) HPGDMGLLROCK2ROCK1DDR1
SCHEMBL23680832 0.83 HPGD (0.53) HPGDMGLLADRA1ADDR1VNN1
SCHEMBL24942880 0.82 HPGD (0.43) HPGDMGLLROCK2ROCK1ADRA1A
SCHEMBL24463761 0.81 HPGD (0.50) HPGDMGLLADRA1AVNN1LRRK2
SCHEMBL23680809 0.80 HPGD (0.50) HPGD
SCHEMBL23680678 0.78 HPGD (0.48) HPGDMGLLADRA1A
SCHEMBL23675348 0.76 HPGD (0.49) HPGDMGLLROCK2ROCK1DDR1
SCHEMBL24942577 0.76 HPGD (0.48) HPGDMGLLROCK2ROCK1DDR1
SCHEMBL24329043 0.74 HPGD (0.54) HPGDMGLLADRA1ADDR1VNN1

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 1025/4885ROCK2 1633/4885

“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.