SCHEMBL1176147

SCHEMBL1176147

C1=COC(c2ccc3ccccc3c2)C1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 12/20 0.51
SLC6A2 P23975 8/20 0.51
SLC6A3 Q01959 8/20 0.51
HTR2C P28335 1/20 0.44
HTR2B P41595 1/20 0.44
KDM4E B2RXH2 1/20 0.43
CYP2D6 P10635 6/20 0.42
KCNH2 Q12809 4/20 0.42
CYP3A4 P08684 1/20 0.38
DRD2 P14416 1/20 0.36

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
SCHEMBL1176145 1.00 SLC6A4 (0.51) SLC6A4SLC6A2SLC6A3HTR2CHTR2B
SCHEMBL29473571 1.00 SLC6A4 (0.51) SLC6A4SLC6A2SLC6A3HTR2CHTR2B
SCHEMBL5156811 0.78 TSHR (0.50) SLC6A4SLC6A2SLC6A3HTR2CHTR2B
SCHEMBL1176630 0.78 TSHR (0.50) SLC6A4SLC6A2SLC6A3HTR2CHTR2B
SCHEMBL5852687 0.76 TSHR (0.54) SLC6A4SLC6A2SLC6A3HTR2CHTR2B
SCHEMBL1119954 0.76 TSHR (0.54) SLC6A4SLC6A2SLC6A3HTR2CHTR2B
SCHEMBL29434698 0.76 TSHR (0.54) SLC6A4SLC6A2SLC6A3HTR2CHTR2B
SCHEMBL10300821 0.76 TSHR (0.54) SLC6A4SLC6A2SLC6A3HTR2CHTR2B
SCHEMBL13241617 0.75 SLC6A2 (0.42) SLC6A4SLC6A2SLC6A3HTR2CHTR2B
SCHEMBL14499061 0.75 SLC6A2 (0.42) SLC6A4SLC6A2SLC6A3HTR2CHTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116854958-A Preparation method of blue light prevention photochromic lens substrate 江苏视科新材料股份有限公司 2023-10-10 CN claimed
CN-116854958-A Preparation method of blue light prevention photochromic lens substrate 江苏视科新材料股份有限公司 2023-10-10 CN disclosed
CN-116731498-A Blue light-proof photochromic resin lens 江苏视科新材料股份有限公司 2023-09-12 CN disclosed
US-9359317-B2 Small molecule inhibitors of HIV proteases PURDUE RESEARCH FOUNDATION (US) 2016-06-07 US disclosed
US-20140135321-A1 SMALL MOLECULE INHIBITORS OF HIV PROTEASES NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2014-05-15 US disclosed
US-20110046199-A1 SMALL MOLECULE INHIBITORS OF HIV PROTEASES PURDUE RESEARCH FOUNDATION (US) 2011-02-24 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 (2 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-20110046199-A1 SMALL MOLECULE INHIBITORS OF HIV PROTEASES SERPINB1, PRSS1, TMPRSS15 SLC6A4 4546/4885SLC6A2 4731/4885SLC6A3 4470/4885
US-20140135321-A1 SMALL MOLECULE INHIBITORS OF HIV PROTEASES SERPINB1, PRSS1, TMPRSS15 SLC6A4 4546/4885SLC6A2 4731/4885SLC6A3 4470/4885

“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.