SCHEMBL25171502

SCHEMBL25171502

Cn1ccc(-c2n[nH]c3ccc(N)cc23)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AXL P30530 8/20 0.64
▸ HTR2A P28223 1/20 0.46
▸ HTR2C P28335 1/20 0.46
▸ HTR2B P41595 1/20 0.46
▸ GSK3B P49841 1/20 0.44
▸ AURKA O14965 1/20 0.43
▸ MAP2K4 P45985 4/20 0.39
▸ MAPK1 P28482 2/20 0.39
▸ MAPKAPK2 P49137 2/20 0.39
▸ MAPKAPK3 Q16644 2/20 0.39
▸ MAPK6 Q16659 2/20 0.39
▸ MAPKAPK5 Q8IW41 2/20 0.39
▸ JAK2 O60674 2/20 0.38
▸ DCLK1 O15075 1/20 0.38
▸ PRKD3 O94806 1/20 0.38
▸ MAP4K4 O95819 1/20 0.38
▸ CHEK2 O96017 1/20 0.38
▸ CSF1R P07333 1/20 0.38
▸ FER P16591 1/20 0.38
▸ CDK2 P24941 1/20 0.38

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
SCHEMBL1663211 0.77 AXL (0.60) AXLHTR2AHTR2CHTR2BGSK3B
SCHEMBL29644093 0.77 AXL (0.57) AXLHTR2AHTR2CHTR2BGSK3B
SCHEMBL22890794 0.77 AXL (0.57) AXLHTR2AHTR2CHTR2BGSK3B
SCHEMBL31423230 0.74 DCLK1 (0.65) AXLHTR2AHTR2CHTR2BAURKA
SCHEMBL12193658 0.74 MKNK1 (0.61) AXLHTR2AHTR2CHTR2BGSK3B
SCHEMBL4008208 0.74 DCLK1 (0.65) AXLHTR2AHTR2CHTR2BAURKA
SCHEMBL12318042 0.74 AXL (0.58) AXLHTR2AHTR2CHTR2BGSK3B
SCHEMBL22890610 0.74 AXL (0.61) AXLHTR2AHTR2CHTR2BGSK3B
SCHEMBL2469031 0.72 AXL (0.55) AXLHTR2AHTR2CHTR2BGSK3B
SCHEMBL4006856 0.72 AXL (0.55) AXLHTR2AHTR2CHTR2BGSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230148214-A1 INDAZOLES AND AZAINDAZOLES AS LRRK2 INHIBITORS ESCAPE Bio, Inc. 2023-05-11 — — US disclosed
US-20230148214-A1 INDAZOLES AND AZAINDAZOLES AS LRRK2 INHIBITORS ESCAPE Bio, Inc. 2023-05-11 — — US 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-20230148214-A1 INDAZOLES AND AZAINDAZOLES AS LRRK2 INHIBITORS LRRK2, PARK7, GDI2 AXL 2469/4885HTR2A 1320/4885HTR2C 1032/4885

“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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