SCHEMBL23779092

SCHEMBL23779092

CCc1cccc2[nH]c(C(=O)N3CCn4nc(NC(=O)C5CCOC5)cc4C3)cc12

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 1/20 0.42
▸ PIP5K1C O60331 6/20 0.40
▸ PIK3CA P42336 6/20 0.40
▸ PTGER1 P34995 1/20 0.38
▸ HRH4 Q9H3N8 8/20 0.38
▸ PIP5K1B O14986 1/20 0.37
▸ MAPK8 P45983 1/20 0.37
▸ MAPK10 P53779 1/20 0.37
▸ MAPK14 Q16539 1/20 0.37
▸ PIP5K1A Q99755 1/20 0.37
▸ ACKR3 P25106 1/20 0.36
▸ POLB P06746 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL23779076 0.90 HRH4 (0.48) SYKPIP5K1CPIK3CAPTGER1HRH4
SCHEMBL24321138 0.88 MAPK10 (0.37) PIP5K1CPIK3CAPTGER1PIP5K1BMAPK8
SCHEMBL23779102 0.85 POLB (0.48) PIP5K1CPIK3CAHRH4PIP5K1BMAPK8
SCHEMBL23779091 0.83 POLB (0.43) PIP5K1CPIK3CAPTGER1HRH4PIP5K1B
SCHEMBL23779042 0.82 POLB (0.38) PIP5K1CPIK3CAPTGER1HRH4PIP5K1B
SCHEMBL23779084 0.82 MAPK10 (0.39) PIP5K1CPIK3CAHRH4PIP5K1BMAPK8
SCHEMBL23779137 0.81 HRH4 (0.39) SYKHRH4
SCHEMBL23779075 0.81 POLB (0.53) HRH4MAPK14POLB
SCHEMBL23779059 0.78 HRH4 (0.46) SYKHRH4MAPK14
SCHEMBL23779113 0.77 HRH4 (0.39) HRH4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220081444-A1 6,7-DIHYDRO-4H-PYRAZOLO[1,5-A]PYRAZINE INDOLE-2-CARBOXAMIDES ACTIVE AGAINST THE HEPATITIS B VIRUS (HBV) AICURIS GMBH & CO. KG (DE) 2022-03-17 — — US disclosed
US-20220081444-A1 6,7-DIHYDRO-4H-PYRAZOLO[1,5-A]PYRAZINE INDOLE-2-CARBOXAMIDES ACTIVE AGAINST THE HEPATITIS B VIRUS (HBV) AICURIS GMBH & CO. KG (DE) 2022-03-17 — — US disclosed
EP-3873910-A1 6,7-DIHYDRO-4H-PYRAZOLO[1,5-A]PYRAZINE INDOLE-2-CARBOXAMIDES ACTIVE AGAINST THE HEPATITIS B VIRUS (HBV) AiCuris GmbH & Co. KG (DE) 2021-09-08 — — 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 (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-20220081444-A1 6,7-DIHYDRO-4H-PYRAZOLO[1,5-A]PYRAZINE INDOLE-2-CARBOXAMIDES ACTIVE AGAINST THE HEPATITIS B VIRUS (HBV) HCCS, CDK2, BRD4 SYK 4649/4885PIP5K1C 1203/4885PIK3CA 2630/4885

“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.

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