SCHEMBL22366709

SCHEMBL22366709

S=C=Nc1cccc(Cl)c1Br

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.46
CYP1A2 P05177 3/20 0.46
TDP1 Q9NUW8 2/20 0.46
ABCB11 O95342 1/20 0.46
NR3C1 P04150 1/20 0.46
CYP3A4 P08684 1/20 0.46
ADRA2A P08913 1/20 0.46
ADORA3 P0DMS8 1/20 0.46
HPGD P15428 1/20 0.46
ALOX15 P16050 1/20 0.46
ADRA2C P18825 1/20 0.46
MAOA P21397 1/20 0.46
DRD1 P21728 1/20 0.46
SLC6A4 P31645 1/20 0.46
HTR2B P41595 1/20 0.46
CCR2 P41597 1/20 0.46
HSD17B10 Q99714 1/20 0.46
GABRA1 P14867 1/20 0.37
GABRB2 P47870 1/20 0.37
APLNR P35414 1/20 0.36

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
SCHEMBL29401833 1.00 ALDH1A1 (0.46) ALDH1A1CYP1A2TDP1ABCB11NR3C1
SCHEMBL1901940 0.80 CYP3A4 (0.50) ALDH1A1CYP1A2TDP1CYP3A4HPGD
SCHEMBL29668094 0.79 ALDH1A1 (0.48) ALDH1A1CYP1A2TDP1ABCB11NR3C1
SCHEMBL895789 0.79 ALDH1A1 (0.48) ALDH1A1CYP1A2TDP1ABCB11NR3C1
SCHEMBL29401009 0.79 ALDH1A1 (0.52) ALDH1A1CYP1A2TDP1ABCB11NR3C1
SCHEMBL458499 0.79 ALDH1A1 (0.52) ALDH1A1CYP1A2TDP1ABCB11NR3C1
SCHEMBL17289579 0.78 ALDH1A1 (0.47) ALDH1A1CYP1A2TDP1ABCB11NR3C1
SCHEMBL7808363 0.76 ALDH1A1 (0.46) ALDH1A1CYP1A2TDP1ABCB11NR3C1
SCHEMBL2768908 0.76 ALDH1A1 (0.46) ALDH1A1CYP1A2TDP1ABCB11NR3C1
SCHEMBL7256052 0.76 ALDH1A1 (0.46) ALDH1A1CYP1A2TDP1ABCB11NR3C1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3958865-B1 4H-PYRROLO[3,2-C]PYRIDIN-4-ONE DERIVATIVES BAYER AG (DE) 2025-12-10 EP disclosed
US-12403135-B2 4H-pyrrolo[3,2-c]pyridin-4-one derivatives BAYER AKTIENGESELLSCHAFT (DE) 2025-09-02 US disclosed
EP-3700904-B1 4H-PYRROLO[3,2-C]PYRIDIN-4-ONE DERIVATIVES BAYER AG (DE) 2023-07-19 EP disclosed
EP-3700904-B1 4H-PYRROLO[3,2-C]PYRIDIN-4-ONE DERIVATIVES BAYER AG (DE) 2023-07-19 EP disclosed
US-20220378762-A1 4H-PYRROLO[3,2-C]PYRIDIN-4-ONE DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 2022-12-01 US disclosed
US-11339157-B1 4H-pyrrolo[3,2-c]pyridin-4-one derivatives BAYER AKTIENGESELLSCHAFT (DE) 2022-05-24 US disclosed
US-11339157-B1 4H-pyrrolo[3,2-c]pyridin-4-one derivatives BAYER AKTIENGESELLSCHAFT (DE) 2022-05-24 US disclosed
EP-3958865-A1 4H-PYRROLO[3,2-C]PYRIDIN-4-ONE DERIVATIVES Bayer Aktiengesellschaft (DE) 2022-03-02 EP disclosed
WO-2020216774-A1 4H-PYRROLO[3,2-C]PYRIDIN-4-ONE DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 2020-10-29 WO disclosed
WO-2020216774-A1 4H-PYRROLO[3,2-C]PYRIDIN-4-ONE DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 2020-10-29 WO disclosed
EP-3700904-A1 4H-PYRROLO[3,2-C]PYRIDIN-4-ONE DERIVATIVES Bayer AG (DE) 2020-09-02 EP 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 (3 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-20220378762-A1 4H-PYRROLO[3,2-C]PYRIDIN-4-ONE DERIVATIVES EGFR, ERBB2, ERBB4 ALDH1A1 1255/4885CYP1A2 577/4885TDP1 1060/4885
US-12403135-B2 4H-pyrrolo[3,2-c]pyridin-4-one derivatives EGFR, ERBB2, ERBB4 ALDH1A1 1255/4885CYP1A2 577/4885TDP1 1060/4885
US-11339157-B1 4H-pyrrolo[3,2-c]pyridin-4-one derivatives CYP4B1, CYP2C19, CYP3A4 ALDH1A1 387/4885CYP1A2 14/4885TDP1 2558/4885

“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.