SCHEMBL5308377

SCHEMBL5308377

CN1CCN(c2cc(F)cc3c2OC(C(=O)Nc2ccc(N4C(=O)CN(C)C4=O)cc2)CC3)CC1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HTR1B P28222 6/20 0.57
▸ KCNH2 Q12809 1/20 0.57
▸ PDE7A Q13946 2/20 0.38
▸ NFKB1 P19838 6/20 0.37
▸ NFKB2 Q00653 6/20 0.37
▸ RELA Q04206 6/20 0.37
▸ SMN1; SMN2 Q16637 3/20 0.35
▸ HTR1A P08908 1/20 0.35
▸ HTR1D P28221 1/20 0.35
▸ HTR2A P28223 1/20 0.35
▸ KDM4E B2RXH2 2/20 0.34
▸ RXFP1 Q9HBX9 1/20 0.34
▸ PARP1 P09874 1/20 0.34
▸ NPC1 O15118 2/20 0.34
▸ RAB9A P51151 2/20 0.34
▸ TP53 P04637 1/20 0.34

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
SCHEMBL5308304 0.89 HTR1B (0.74) HTR1BKCNH2PDE7ANFKB1NFKB2
SCHEMBL14529628 0.88 HTR1B (0.55) HTR1BKCNH2PDE7ANFKB1NFKB2
SCHEMBL4250243 0.88 HTR1B (0.71) HTR1BKCNH2NFKB1NFKB2RELA
SCHEMBL5309051 0.88 HTR1B (0.58) HTR1BKCNH2NFKB1NFKB2RELA
SCHEMBL22410996 0.87 HTR1B (0.53) HTR1BKCNH2PDE7ANFKB1NFKB2
SCHEMBL5332698 0.86 HTR1B (0.57) HTR1BKCNH2NFKB1NFKB2RELA
SCHEMBL5311900 0.85 HTR1B (0.57) HTR1BKCNH2NFKB1NFKB2RELA
SCHEMBL5308374 0.85 HTR1B (0.59) HTR1BKCNH2SMN1; SMN2KDM4ERXFP1
SCHEMBL5308451 0.85 HTR1B (0.78) HTR1BKCNH2SMN1; SMN2HTR1AHTR1D
SCHEMBL5373842 0.85 HTR1B (0.57) HTR1BKCNH2NFKB1NFKB2RELA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070135442-A1 Chroman compounds ASTRAZENECA AB (SE) 2007-06-14 — — US claimed
WO-2007053094-A1 CHROMAN COMPOUNDS AS 5 -HTlB ANTAGONISTS ASTRAZENECA AB (SE) 2007-05-10 — — WO claimed
US-20070135442-A1 Chroman compounds ASTRAZENECA AB (SE) 2007-06-14 — — US disclosed
US-20070135442-A1 Chroman compounds ASTRAZENECA AB (SE) 2007-06-14 — — US disclosed
US-20070135442-A1 Chroman compounds ASTRAZENECA AB (SE) 2007-06-14 — — US disclosed
WO-2007053094-A1 CHROMAN COMPOUNDS AS 5 -HTlB ANTAGONISTS ASTRAZENECA AB (SE) 2007-05-10 — — WO disclosed
WO-2007053094-A1 CHROMAN COMPOUNDS AS 5 -HTlB ANTAGONISTS ASTRAZENECA AB (SE) 2007-05-10 — — 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-20070135442-A1 Chroman compounds CYP3A43, CYP2C9, CYP2C8 HTR1B 592/4885KCNH2 1018/4885PDE7A 2220/4885

“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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