SCHEMBL22058384

SCHEMBL22058384

CN1CCC(=O)c2c1nc(Cl)[nH]c2=O

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ HRH4 Q9H3N8 2/20 0.31
▸ TNKS O95271 3/20 0.31
▸ PARP1 P09874 3/20 0.31
▸ TNKS2 Q9H2K2 3/20 0.31

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
SCHEMBL20954788 0.74 TNKS (0.51) TNKSPARP1TNKS2
SCHEMBL21989251 0.73 — —
SCHEMBL20955731 0.65 TNKS (0.43) TNKSPARP1TNKS2
SCHEMBL20954967 0.62 POLB (0.40) TNKSPARP1TNKS2
SCHEMBL9955521 0.61 SMN1; SMN2 (0.42) TNKSPARP1TNKS2
SCHEMBL16710701 0.57 CYP2C19 (0.39) HRH4
SCHEMBL1339261 0.57 — —
SCHEMBL3542184 0.56 SMN1; SMN2 (0.40) —
SCHEMBL3425801 0.55 ADORA3 (0.36) —
SCHEMBL3390495 0.55 KMT2A (0.41) PARP1

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-11414429-B2 Compound or pharmaceutically acceptable salt thereof RIKEN (JP) 2022-08-16 — — US disclosed
US-20200172554-A1 NOVEL COMPOUND OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF RIKEN (JP) 2020-06-04 — — 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 (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-11414429-B2 Compound or pharmaceutically acceptable salt thereof DPP8, DPP7, AZI2 HRH4 2602/4885TNKS 3604/4885PARP1 1705/4885
US-20200172554-A1 NOVEL COMPOUND OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF DPP8, DPP7, AZI2 HRH4 2495/4885TNKS 3690/4885PARP1 1906/4885

“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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