SCHEMBL22968017

SCHEMBL22968017

CC(=O)N1CCC(COc2cnc(Cl)cc2C)CC1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CYP4F2 P78329 1/20 0.44
▸ CYP4A11 Q02928 1/20 0.44
▸ TRPC6 Q9Y210 4/20 0.42
▸ IRAK4 Q9NWZ3 1/20 0.42
▸ F10 P00742 2/20 0.41
▸ IKBKE Q14164 3/20 0.41
▸ TBK1 Q9UHD2 3/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ ATM Q13315 1/20 0.41
▸ NPC1 O15118 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ HDAC3 O15379 2/20 0.39
▸ HDAC1 Q13547 2/20 0.39
▸ HDAC2 Q92769 2/20 0.39
▸ CHEK2 O96017 1/20 0.39
▸ F2 P00734 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
SCHEMBL15351178 0.83 CHRNB2 (0.39) —
SCHEMBL22968018 0.78 SSTR4 (0.48) CYP4F2CYP4A11IRAK4F10IKBKE
SCHEMBL22968108 0.77 CYP4A11 (0.70) CYP4F2CYP4A11
SCHEMBL22756234 0.76 PRMT5 (0.51) CYP4F2CYP4A11TRPC6
SCHEMBL19477443 0.72 CYP4F2 (0.48) CYP4F2CYP4A11IRAK4F10IKBKE
SCHEMBL20590891 0.72 CYP4F2 (0.51) CYP4F2CYP4A11F10MEN1KMT2A
SCHEMBL14771896 0.72 IKBKE (0.49) IKBKETBK1
SCHEMBL23434873 0.71 IRAK4 (0.45) CYP4F2CYP4A11IRAK4F10IKBKE
SCHEMBL16094190 0.71 GPR119 (0.46) CHEK2
SCHEMBL791389 0.70 CYP2C9 (0.53) CYP4F2CYP4A11F10MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210040062-A1 AZOLE-SUBSTITUTED PYRIDINE COMPOUND TAISHO PHARMACEUTICAL CO., LTD. (JP) 2021-02-11 — — 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-20210040062-A1 AZOLE-SUBSTITUTED PYRIDINE COMPOUND CYP2F1, CYP21A2, CYP11B1 CYP4F2 8/4885CYP4A11 13/4885TRPC6 2500/4885

“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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