SCHEMBL7679724

SCHEMBL7679724

O=C(O)N1CCc2c(n3c4c(ccc(Cl)c24)OCC3)CC1

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
MCL1 Q07820 2/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.30
EGLN1 Q9GZT9 1/20 0.30

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
SCHEMBL7676778 0.85 HTR2C (0.37) HTR2AHTR2CMCL1PTGDR2EGLN1
SCHEMBL6851580 0.84 MCL1 (0.32) HTR2AHTR2CMCL1
SCHEMBL7674690 0.82 PTGDR (0.31) PTGDR2
SCHEMBL6497051 0.82 HTR2A (0.34) HTR2AHTR2CMCL1
SCHEMBL6493912 0.82 MEN1 (0.47) PTGDR2
SCHEMBL7680290 0.81 NOTUM (0.33) MCL1PTGDR2
SCHEMBL7673244 0.81 MAPT (0.30) HTR2AHTR2C
SCHEMBL7670341 0.78 MCL1 (0.42) HTR2AHTR2CMCL1PTGDR2
SCHEMBL6852208 0.78 HTR2A (0.31) HTR2AHTR2CMCL1PTGDR2
SCHEMBL6850359 0.77 HTR2C (0.60) HTR2AHTR2C

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-20020198190-A1 Tetracyclic azepinoindole compounds PHARMACIA & UPJOHN COMPANY 2002-12-26 US claimed
US-20020198190-A1 Tetracyclic azepinoindole compounds PHARMACIA & UPJOHN COMPANY 2002-12-26 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-20020198190-A1 Tetracyclic azepinoindole compounds TPH1, AZI2, CYP1A2 HTR2A 43/4885HTR2C 24/4885MCL1 493/4885

“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.