SCHEMBL7672209

SCHEMBL7672209

O=C(O)N1CCc2c(n3c4c(c(F)ccc24)OCC3)CC1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 2/20 0.36
HTR2A P28223 1/20 0.36
PTGDR2 Q9Y5Y4 3/20 0.33
MCL1 Q07820 2/20 0.32
BCL2 P10415 1/20 0.32
FABP3 P05413 1/20 0.31
RIPK1 Q13546 1/20 0.31
AHR P35869 1/20 0.31
FABP4 P15090 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL7670341 0.85 MCL1 (0.42) HTR2CHTR2APTGDR2MCL1BCL2
SCHEMBL6492896 0.83 PTGDR2 (0.50) PTGDR2MEN1KMT2A
Maleic Acid SCHEMBL6485995 0.78 HTR2C (0.50) HTR2CHTR2AMEN1KMT2A
Fumaric Acid SCHEMBL6486001 0.78 HTR2C (0.50) HTR2CHTR2AMEN1KMT2A
SCHEMBL7676778 0.78 HTR2C (0.37) HTR2CHTR2APTGDR2MCL1AHR
SCHEMBL6851480 0.77 HTR2C (0.60) HTR2CHTR2AMEN1KMT2A
SCHEMBL7673579 0.76 HTR2A (0.38) HTR2CHTR2APTGDR2MCL1RIPK1
SCHEMBL7037197 0.74 DPP4 (0.35) PTGDR2FABP3FABP4MEN1KMT2A
SCHEMBL7673368 0.73 HTR2C (0.41) HTR2CHTR2APTGDR2MCL1
SCHEMBL6852208 0.73 HTR2A (0.31) HTR2CHTR2APTGDR2MCL1

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 HTR2C 24/4885HTR2A 43/4885PTGDR2 314/4885

“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.