SCHEMBL481617

SCHEMBL481617

COc1cc(OC)c(I)cc1I

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 5/20 0.47
HTR2C P28335 5/20 0.47
CYP3A4 P08684 5/20 0.47
HTR2B P41595 4/20 0.47
HTR1A P08908 2/20 0.47
TSHR P16473 2/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2D6 P10635 1/20 0.47
NFKB1 P19838 1/20 0.47
PMP22 Q01453 2/20 0.45
LMNA P02545 1/20 0.45
MAPT P10636 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
CA9 Q16790 2/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA4 P22748 1/20 0.38

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
SCHEMBL28211962 0.91 HTR2A (0.50) HTR2AHTR2CCYP3A4HTR2BHTR1A
SCHEMBL481337 0.90 HTR2A (0.54) HTR2AHTR2CCYP3A4HTR2BHTR1A
SCHEMBL8234499 0.84 HTR2A (0.41) HTR2AHTR2CCYP3A4HTR2BHTR1A
SCHEMBL16024606 0.82 PDE4A (0.44) HTR2AHTR2CCYP3A4HTR2BHTR1A
SCHEMBL5038230 0.82 NPC1 (0.45) HTR2AHTR2CCYP3A4HTR2BHTR1A
SCHEMBL22025397 0.82 HTR2A (0.40) HTR2AHTR2CCYP3A4HTR2BHTR1A
SCHEMBL6816222 0.82 GAA (0.56) HTR2AHTR2CCYP3A4HTR2BHTR1A
SCHEMBL21614376 0.82 ACHE (0.43) HTR2AHTR2CCYP3A4HTR2BHTR1A
SCHEMBL4159527 0.78 GAA (0.41) HTR2AHTR2CCYP3A4HTR2BHTR1A
SCHEMBL7139169 0.78 HTR2A (0.46) HTR2AHTR2CCYP3A4HTR2BHTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106748604-B Method for synthesizing mono-iodo aromatic hydrocarbon or di-iodo aromatic hydrocarbon based on decarboxylation of aromatic carboxylic acid 湘潭大学 2020-06-05 CN claimed
CN-106748604-A A kind of method for synthesizing single iodo aromatic hydrocarbon or two iodo aromatic hydrocarbons based on aromatic carboxylic acid's decarboxylic reaction 湘潭大学 2017-05-31 CN claimed
CN-106748604-B Method for synthesizing mono-iodo aromatic hydrocarbon or di-iodo aromatic hydrocarbon based on decarboxylation of aromatic carboxylic acid 湘潭大学 2020-06-05 CN disclosed
CN-106748604-A A kind of method for synthesizing single iodo aromatic hydrocarbon or two iodo aromatic hydrocarbons based on aromatic carboxylic acid's decarboxylic reaction 湘潭大学 2017-05-31 CN disclosed
EP-1837324-B1 PROCESS FOR PRODUCING AROMATIC IODINE COMPOUND NIPPOH CHEMICALS (JP) 2012-02-01 EP disclosed
EP-1837324-B1 PROCESS FOR PRODUCING AROMATIC IODINE COMPOUND NIPPOH CHEMICALS (JP) 2012-02-01 EP disclosed
US-7514589-B2 Method for producing aromatic iodides NIPPOH CHEMICALS CO., LTD. (JP) 2009-04-07 US disclosed
US-7514589-B2 Method for producing aromatic iodides NIPPOH CHEMICALS CO., LTD. (JP) 2009-04-07 US disclosed
US-7514589-B2 Method for producing aromatic iodides NIPPOH CHEMICALS CO., LTD. (JP) 2009-04-07 US disclosed
US-20080146853-A1 Method for Producing Aromatic Iodides NIPPOH CHEMICALS CO., LTD. (JP) 2008-06-19 US disclosed
US-20080146853-A1 Method for Producing Aromatic Iodides NIPPOH CHEMICALS CO., LTD. (JP) 2008-06-19 US disclosed
US-20080146853-A1 Method for Producing Aromatic Iodides NIPPOH CHEMICALS CO., LTD. (JP) 2008-06-19 US disclosed
EP-1837324-A1 PROCESS FOR PRODUCING AROMATIC IODINE COMPOUND Nippoh Chemicals Co., Ltd (JP) 2007-09-26 EP disclosed
EP-1837324-A1 PROCESS FOR PRODUCING AROMATIC IODINE COMPOUND Nippoh Chemicals Co., Ltd (JP) 2007-09-26 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-20080146853-A1 Method for Producing Aromatic Iodides TYR, NISCH, TH HTR2A 475/4885HTR2C 339/4885CYP3A4 16/4885

“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.