SCHEMBL2234061

SCHEMBL2234061

OCc1ncn2c1CCc1ccncc1-2

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
HTR2B P41595 1/20 0.32
SIGMAR1 Q99720 1/20 0.32
CHRM2 P08172 2/20 0.31
CHRM3 P20309 2/20 0.31
CHRM1 P11229 1/20 0.31
CHRM4 P08173 1/20 0.30
CYP11B2 P19099 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
SCHEMBL2233887 0.76 ALDH1A1 (0.35)
SCHEMBL2234080 0.74 CPB2 (0.42)
SCHEMBL2234274 0.72 L3MBTL1 (0.38)
SCHEMBL2233615 0.72 GABRG2 (0.53)
SCHEMBL2234063 0.69 KCNJ1 (0.33)
SCHEMBL2234603 0.69 GABRG2 (0.34)
SCHEMBL2235539 0.68 NOTUM (0.38) HTR2AHTR2CCYP11B2
SCHEMBL2234758 0.68 HCAR1 (0.36) HTR2CHTR2B
SCHEMBL10293863 0.66 GABRG2 (0.50) HTR2AHTR2CHTR2BCHRM2CHRM3
SCHEMBL8224589 0.61 PTPRA (0.40)

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-20110213143-A1 COMPOUND HAVING TAFIA INHIBITORY ACTIVITY TAISHO PHARMACEUTICAL CO., LTD. (JP) 2011-09-01 US disclosed
EP-2361910-A1 COMPOUND HAVING TAFIA INHIBITORY ACTIVITY Taisho Pharmaceutical Co., Ltd. (JP) 2011-08-31 EP 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-20110213143-A1 COMPOUND HAVING TAFIA INHIBITORY ACTIVITY TAF1, TAF5, TAF11 HTR2A 4341/4885HTR2C 3277/4885HTR2B 2045/4885

“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.