SCHEMBL22617006

SCHEMBL22617006

c1ccc(COCC2CCCN(c3ncnc4ccccc34)C2)cc1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PRKDC P78527 5/20 0.53
▸ HRH1 P35367 1/20 0.48
▸ HRH3 Q9Y5N1 1/20 0.48
▸ KIT P10721 4/20 0.47
▸ PDGFRA P16234 1/20 0.47
▸ FLT3 P36888 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ HTT P42858 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ PDE3A Q14432 2/20 0.47
▸ GBA1 P04062 1/20 0.46
▸ CTSL P07711 1/20 0.46
▸ CTSB P07858 1/20 0.46
▸ CTSK P43235 1/20 0.46
▸ PTK2 Q05397 1/20 0.44
▸ HRH4 Q9H3N8 1/20 0.44

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
SCHEMBL22616946 0.82 CTSL (0.46) PRKDCGBA1CTSLCTSBCTSK
SCHEMBL21664309 0.73 LMNA (0.50) PRKDCHRH1HRH3LMNAHTT
SCHEMBL22616952 0.72 HRH3 (0.54) HRH3CTSLCTSBCTSKHRH4
SCHEMBL22616951 0.72 HRH3 (0.54) HRH3CTSLCTSBCTSKHRH4
SCHEMBL22623265 0.72 HRH3 (0.54) HRH3CTSLCTSBCTSKHRH4
SCHEMBL31065671 0.72 NPSR1 (0.53) PRKDCHRH1HRH3LMNAHTT
SCHEMBL11015775 0.72 PTK2 (0.73) PRKDCHRH1HRH3KITPDGFRA
SCHEMBL26558270 0.71 LMNA (0.47) PRKDCHRH1HRH3KITPDGFRA
SCHEMBL27685353 0.71 CTSK (0.56) CTSLCTSBCTSK
SCHEMBL30821993 0.70 PTK2 (0.71) PRKDCHRH1HRH3KITPDGFRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220213055-A1 SUBSTITUTED (PIPERIDIN-1-YL)ARYL ANALOGUES FOR MODULATING AVIL ACTIVITY UNIV VIRGINIA PATENT FOUNDATION (US) 2022-07-07 — — US disclosed
US-20220213055-A1 SUBSTITUTED (PIPERIDIN-1-YL)ARYL ANALOGUES FOR MODULATING AVIL ACTIVITY UNIV VIRGINIA PATENT FOUNDATION (US) 2022-07-07 — — US disclosed
EP-3962485-A1 SUBSTITUTED (PIPERIDIN-1-YL)ARYL ANALOGUES FOR MODULATING AVILACTIVITY University Of Virginia Patent Foundation (US) 2022-03-09 — — EP disclosed
WO-2020223715-A1 SUBSTITUTED (PIPERIDIN-1-YL)ARYL ANALOGUES FOR MODULATING AVILACTIVITY UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) 2020-11-05 — — WO disclosed
WO-2020223715-A1 SUBSTITUTED (PIPERIDIN-1-YL)ARYL ANALOGUES FOR MODULATING AVILACTIVITY UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) 2020-11-05 — — WO 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-20220213055-A1 SUBSTITUTED (PIPERIDIN-1-YL)ARYL ANALOGUES FOR MODULATING AVIL ACTIVITY VCL, VPS28, HDLBP PRKDC 2558/4885HRH1 3640/4885HRH3 3683/4885

“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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