SCHEMBL30032447

SCHEMBL30032447

O=C(NC1CN(Cc2ccc(F)c(O)c2)C1)c1cnc2cccnn12

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 1/20 0.43
▸ FAAH O00519 2/20 0.41
▸ PDE4B Q07343 8/20 0.40
▸ PDE4D Q08499 7/20 0.40
▸ PDE4C Q08493 6/20 0.40
▸ PDE4A P27815 5/20 0.40
▸ NTRK1 P04629 3/20 0.40
▸ ABL1 P00519 1/20 0.38
▸ DRD2 P14416 1/20 0.37
▸ DRD4 P21917 1/20 0.37
▸ HTR2A P28223 1/20 0.37
▸ MCHR1 Q99705 2/20 0.37
▸ HDAC1 Q13547 1/20 0.37

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
SCHEMBL30056436 0.93 DRD2 (0.46) HSD11B1FAAHDRD2DRD4HTR2A
SCHEMBL30056726 0.93 DRD2 (0.46) HSD11B1FAAHDRD2DRD4HTR2A
SCHEMBL30057558 0.91 MCHR1 (0.48) DRD4MCHR1
SCHEMBL30057602 0.85 HSD11B1 (0.46) HSD11B1FAAHPDE4BPDE4DPDE4C
SCHEMBL21765957 0.82 NTRK1 (0.40) NTRK1
SCHEMBL30611797 0.80 HDAC1 (0.45) HSD11B1NTRK1HDAC1
SCHEMBL30056768 0.79 DRD2 (0.47) HSD11B1FAAHDRD2DRD4HTR2A
SCHEMBL30057712 0.79 DRD2 (0.47) HSD11B1FAAHDRD2DRD4HTR2A
SCHEMBL30056061 0.76 SIGMAR1 (0.53) HSD11B1NTRK1DRD4MCHR1
SCHEMBL26549318 0.74 CACNA1G (0.42) NTRK1MCHR1

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
CN-112805062-B Imidazo [1,2-b ] pyridazines as Trk inhibitors 博善人工智能生物科技有限公司 2024-06-04 — — CN claimed
EP-3840832-B1 IMIDAZO[1,2-B]PYRIDAZINES AS TRK INHIBITORS BENEVOLENTAI BIO LTD (GB) 2023-10-11 — — EP claimed
US-20230149398-A1 TOPICAL PHARMACEUTICAL COMPOSITIONS COMPRISING IMIDAZO[1,2-B]PYRIDAZINE COMPOUNDS BENEVOLENTAI BIO LIMITED (GB) 2023-05-18 — — US claimed
EP-4093404-A1 TOPICAL PHARMACEUTICAL COMPOSITIONS COMPRISING IMIDAZO[1,2-B]PYRIDAZINE COMPOUNDS BenevolentAI Bio Limited (GB) 2022-11-30 — — EP claimed
CN-115297863-A Topical pharmaceutical compositions comprising imidazo [1,2-b ] pyridazine compounds 博善人工智能生物科技有限公司 2022-11-04 — — CN claimed
CN-112805062-B Imidazo [1,2-b ] pyridazines as Trk inhibitors 博善人工智能生物科技有限公司 2024-06-04 — — CN disclosed
EP-3840832-B1 IMIDAZO[1,2-B]PYRIDAZINES AS TRK INHIBITORS BENEVOLENTAI BIO LTD (GB) 2023-10-11 — — EP disclosed
US-20230149398-A1 TOPICAL PHARMACEUTICAL COMPOSITIONS COMPRISING IMIDAZO[1,2-B]PYRIDAZINE COMPOUNDS BENEVOLENTAI BIO LIMITED (GB) 2023-05-18 — — US disclosed
EP-4093404-A1 TOPICAL PHARMACEUTICAL COMPOSITIONS COMPRISING IMIDAZO[1,2-B]PYRIDAZINE COMPOUNDS BenevolentAI Bio Limited (GB) 2022-11-30 — — EP disclosed
CN-115297863-A Topical pharmaceutical compositions comprising imidazo [1,2-b ] pyridazine compounds 博善人工智能生物科技有限公司 2022-11-04 — — CN 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-20230149398-A1 TOPICAL PHARMACEUTICAL COMPOSITIONS COMPRISING IMIDAZO[1,2-B]PYRIDAZINE COMPOUNDS TNK2, TNIK, TNK1 HSD11B1 2310/4885FAAH 3328/4885PDE4B 848/4885

“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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