SCHEMBL7600224

SCHEMBL7600224

ON1CCc2ccc3occc3c21

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 2/20 0.42
HTR2A P28223 1/20 0.42
HTR2B P41595 1/20 0.42
HTR1A P08908 1/20 0.33
DRD3 P35462 1/20 0.33
SIGMAR1 Q99720 3/20 0.32
NFKB1 P19838 1/20 0.31
MAOA P21397 1/20 0.31
MAOB P27338 1/20 0.31
EED O75530 1/20 0.31
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30
SLC6A3 Q01959 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
Ammonia Solution, Strong SCHEMBL14677992 0.98 HTR2C (0.41) HTR2CHTR2AHTR2BHTR1ADRD3
SCHEMBL30000911 0.79 HTR2C (0.42) HTR2CHTR2AHTR2BHTR1ADRD3
SCHEMBL9411933 0.79 HTR2C (0.40) HTR2CHTR2AHTR2BHTR1ADRD3
SCHEMBL5743895 0.76 HTR2C (0.40) HTR2CHTR2AHTR2BHTR1ADRD3
SCHEMBL25240958 0.66 HTR1D (0.41) DRD3
SCHEMBL4429415 0.65 PAX8 (0.48) HTR2CHTR2AHTR2BNFKB1MAOA
SCHEMBL13983903 0.63 HTR2C (0.66) HTR2CHTR2AHTR2BHTR1ADRD3
SCHEMBL3633037 0.62 HTR2A (0.46) HTR2CHTR2AHTR2BHTR1ADRD3
SCHEMBL1555111 0.61 HTR2A (0.45) HTR2CHTR2AHTR2BHTR1ADRD3
SCHEMBL9411925 0.61 HTR2C (0.57) HTR2CHTR2AHTR2BHTR1ADRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140315956-A1 SMALL MOLECULE INHIBITORS OF IL-6 AND USES THEREOF NATIONWIDE CHILDREN'S HOSPITAL (US) 2014-10-23 US disclosed
WO-2013019690-A1 SMALL MOLECULE INHIBITORS OF IL-6 AND USES THEREOF THE OHIO STATE UNIVERSITY (US) 2013-02-07 WO disclosed
JP-2002212186-A METHOD FOR PRODUCING MADINDOLINE A AND B JAPAN SCIENCE & TECHNOLOGY CORP 2002-07-31 JP 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-20140315956-A1 SMALL MOLECULE INHIBITORS OF IL-6 AND USES THEREOF IL6, STAT3, JAK2 HTR2C 781/4885HTR2A 1015/4885HTR2B 1285/4885

“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.