SCHEMBL23629664

SCHEMBL23629664

c1nnc2n1CCNCC2

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 1/20 0.57
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
BPTF Q12830 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
ADRB2 P07550 1/20 0.31
NCF1 P14598 1/20 0.31
PLD1 Q13393 1/20 0.31
CXCR4 P61073 1/20 0.30

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
SCHEMBL109072 0.82
Hydrochloric Acid SCHEMBL1578935 0.80 PDPK1 (0.47) PDPK1KDM4EALDH1A1
Hydrochloric Acid SCHEMBL1524330 0.80 PDPK1 (0.47) PDPK1
SCHEMBL348289 0.74
SCHEMBL6850314 0.72
SCHEMBL19866137 0.71 PDPK1 (0.55) PDPK1CXCR4
SCHEMBL4073713 0.68 HRH1 (0.38) HTR2AHTR2CKDM4EALDH1A1ADRB2
SCHEMBL23931174 0.68 PDPK1 (0.57) PDPK1
SCHEMBL24566373 0.67 PDPK1 (0.66) PDPK1
SCHEMBL18501362 0.67 PDPK1 (0.60) PDPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12030869-B2 5-membered heteroaryl carboxamide compounds for treatment of HBV ASSEMBLY BIOSCIENCES, INC. (US) 2024-07-09 US disclosed
EP-4139000-A1 PYRAZOLE CARBOXAMIDE COMPOUNDS FOR TREATMENT OF HBV Assembly Biosciences, Inc. (US) 2023-03-01 EP disclosed
EP-4139292-A1 5-MEMBERED HETEROARYL CARBOXAMIDE COMPOUNDS FOR TREATMENT OF HBV Assembly Biosciences, Inc. (US) 2023-03-01 EP disclosed
US-20220143042-A1 FUSED GLYCOSIDASE INHIBITORS ASCENEURON SA (CH) 2022-05-12 US disclosed
WO-2021216642-A1 PYRAZOLE CARBOXAMIDE COMPOUNDS FOR TREATMENT OF HBV ASSEMBLY BIOSCIENCES, INC. (US) 2021-10-28 WO disclosed
WO-2021216656-A1 5-MEMBERED HETEROARYL CARBOXAMIDE COMPOUNDS FOR TREATMENT OF HBV ASSEMBLY BIOSCIENCES, INC. (US) 2021-10-28 WO disclosed
WO-2021216661-A1 PYRAZOLE CARBOXAMIDE COMPOUNDS FOR TREATMENT OF HBV ASSEMBLY BIOSCIENCES, INC. (US) 2021-10-28 WO disclosed
WO-2021216660-A1 5-MEMBERED HETEROARYL CARBOXAMIDE COMPOUNDS FOR TREATMENT OF HBV ASSEMBLY BIOSCIENCES, INC. (US) 2021-10-28 WO disclosed
EP-3847162-A1 CYCLIC SULFAMIDE COMPOUNDS FOR TREATMENT OF HBV Assembly Biosciences, Inc. (US) 2021-07-14 EP disclosed
EP-3846820-A1 CYCLIC SULFAMIDE COMPOUNDS FOR TREATMENT OF HBV Assembly Biosciences, Inc. (US) 2021-07-14 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 (2 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-20220143042-A1 FUSED GLYCOSIDASE INHIBITORS BACE1, ENGASE, GBA3 PDPK1 4306/4885HTR2A 3672/4885HTR2C 4513/4885
US-12030869-B2 5-membered heteroaryl carboxamide compounds for treatment of HBV HCCS, HAVCR2, MAVS PDPK1 2819/4885HTR2A 3788/4885HTR2C 3656/4885

“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.