SCHEMBL454020

SCHEMBL454020

CC1=CCCc2cc(OCc3ccccc3)ccc21

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAOB P27338 10/20 0.58
MAOA P21397 9/20 0.58
HRH3 Q9Y5N1 4/20 0.53
TOP1 P11387 1/20 0.47
ALOX5 P09917 1/20 0.46
NPC1 O15118 1/20 0.46
ALDH1A1 P00352 1/20 0.46
HPGD P15428 1/20 0.46
NFKB1 P19838 1/20 0.46
GRM5 P41594 1/20 0.46
RAB9A P51151 1/20 0.46
NFKB2 Q00653 1/20 0.46
RELA Q04206 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
FFAR4 Q5NUL3 1/20 0.45
SRD5A1 P18405 1/20 0.45

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
SCHEMBL30816075 1.00 MAOB (0.58) MAOBMAOAHRH3TOP1ALOX5
SCHEMBL29248710 0.86 MAOB (0.55) MAOBMAOAHRH3TOP1ALOX5
SCHEMBL21983033 0.84 MAOB (0.59) MAOBMAOAHRH3TOP1ALOX5
SCHEMBL451473 0.84 MAOB (0.56) MAOBMAOAFFAR4
SCHEMBL23740183 0.82 MAOB (0.56) MAOBMAOAHRH3TOP1ALOX5
SCHEMBL18815890 0.78 MAOA (0.52) MAOBMAOAHRH3TOP1NPSR1
SCHEMBL29966533 0.78 MAOB (0.53) MAOBMAOAHRH3TOP1
SCHEMBL10088401 0.77 MAOB (0.62) MAOBMAOANPC1ALDH1A1HPGD
SCHEMBL23297253 0.77 MPO (0.50) MAOBMAOAHRH3NPSR1
SCHEMBL28445218 0.77 MAOB (0.51) MAOBMAOAHRH3TOP1ALOX5

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 38 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240327342-A1 COMPOUNDS HAVING S1P5 RECEPTOR AGONISTIC ACTIVITY ONO PHARMACEUTICAL CO., LTD. (JP) 2024-10-03 US disclosed
EP-4431157-A2 1-[[(3S)-3-METHYL-6-(4(4,4-TRIFLUOROBUTOXY)-3,4-DIHYDRONAPHTHALEN-2YL]METHYL]AZETIDINE-3-CARBOXYLIC ACID HAVING S1P5 RECEPTOR AGONIST ACTIVITY FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS AND CANCER ONO Pharmaceutical Co., Ltd. (JP) 2024-09-18 EP disclosed
US-12049445-B2 Compounds having S1P5 receptor agonistic activity ONO PHARMACEUTICAL CO., LTD. (JP) 2024-07-30 US disclosed
US-11471436-B2 Dihydronaphthalene derivative ONO PHARMACEUTICAL CO., LTD. (JP) 2022-10-18 US disclosed
US-20220055986-A1 COMPOUNDS HAVING S1P5 RECEPTOR AGONISTIC ACTIVITY ONO PHARMACEUTICAL CO., LTD. (JP) 2022-02-24 US disclosed
US-11198672-B2 Compounds having S1P5 receptor agonistic activity ONO PHARMACEUTICAL CO., LTD. (JP) 2021-12-14 US disclosed
US-20210087141-A1 COMPOUNDS HAVING S1P5 RECEPTOR AGONISTIC ACTIVITY ONO PHARMACEUTICAL CO., LTD. (JP) 2021-03-25 US disclosed
EP-3228615-B1 DIHYDRONAPHTHALENE DERIVATIVES USEFUL IN THE TREATMENT OF S1P5-MEDIATED DISEASES ONO PHARMACEUTICAL CO (JP) 2021-01-20 EP disclosed
EP-3757091-A1 COMPOUND HAVING S1P5 RECEPTOR AGONIST ACTIVITY ONO Pharmaceutical Co., Ltd. (JP) 2020-12-30 EP disclosed
CN-111757869-A Compounds having S1P5 receptor agonistic activity 小野药品工业株式会社 2020-10-09 CN disclosed
US-20110105432-A1 AMINOCARBOXYLIC ACID DERIVATIVE AND MEDICINAL USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2011-05-05 US disclosed
US-7906549-B2 Aminocarboxylic acid derivative and medicinal use thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2011-03-15 US disclosed
US-20110020324-A1 COMPOUND CAPABLE OF BINDING S1P RECEPTOR AND PHARMACEUTICAL USE THEREOF ONO PHARMACEUTICAL CO., LTD (JP) 2011-01-27 US disclosed
US-7825109-B2 Compound capable of binding S1P receptor and pharmaceutical use thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2010-11-02 US disclosed
US-20090275554-A1 AMINOCARBOXYLIC ACID DERIVATIVE AND MEDICINAL USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2009-11-05 US disclosed
US-20080207584-A1 Compound Having S1P Receptor Binding Potency and Use Thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2008-08-28 US disclosed
EP-1826197-A1 AMINOCARBOXYLIC ACID DERIVATIVE AND MEDICINAL USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2007-08-29 EP disclosed
US-20070167425-A1 Compound capable of binding s1p receptor and pharmaceutical use thereof ONO PHARMACEUTICAL CO., LTD (JP) 2007-07-19 US disclosed
EP-1760071-A1 COMPOUND HAVING S1P RECEPTOR BINDING POTENCY AND USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2007-03-07 EP disclosed
EP-1661881-A2 COMPOUND CAPABLE OF BINDING S1P RECEPTOR AND PHARMACEUTICAL USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2006-05-31 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 (11 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-12049445-B2 Compounds having S1P5 receptor agonistic activity S1PR5, S1PR1, S1PR4 MAOB 2121/4885MAOA 2474/4885HRH3 866/4885
US-20240327342-A1 COMPOUNDS HAVING S1P5 RECEPTOR AGONISTIC ACTIVITY S1PR5, S1PR1, S1PR4 MAOB 2121/4885MAOA 2474/4885HRH3 866/4885
US-20110105432-A1 AMINOCARBOXYLIC ACID DERIVATIVE AND MEDICINAL USE THEREOF EDNRA, EDNRB, S1PR1 MAOB 1836/4885MAOA 1581/4885HRH3 938/4885
US-11198672-B2 Compounds having S1P5 receptor agonistic activity S1PR5, S1PR1, S1PR4 MAOB 2121/4885MAOA 2474/4885HRH3 866/4885
US-20210087141-A1 COMPOUNDS HAVING S1P5 RECEPTOR AGONISTIC ACTIVITY S1PR5, S1PR1, S1PR4 MAOB 2121/4885MAOA 2474/4885HRH3 866/4885
US-11471436-B2 Dihydronaphthalene derivative S1PR5, LPAR5, S1PR1 MAOB 1406/4885MAOA 1661/4885HRH3 334/4885
US-20070167425-A1 Compound capable of binding s1p receptor and pharmaceutical use thereof S1PR1, S1PR3, S1PR2 MAOB 2689/4885MAOA 3402/4885HRH3 96/4885
US-20220055986-A1 COMPOUNDS HAVING S1P5 RECEPTOR AGONISTIC ACTIVITY S1PR5, S1PR1, S1PR4 MAOB 2121/4885MAOA 2474/4885HRH3 866/4885
US-20080207584-A1 Compound Having S1P Receptor Binding Potency and Use Thereof S1PR1, EDNRA, S1PR3 MAOB 2137/4885MAOA 2174/4885HRH3 94/4885
US-20110020324-A1 COMPOUND CAPABLE OF BINDING S1P RECEPTOR AND PHARMACEUTICAL USE THEREOF S1PR1, S1PR3, S1PR2 MAOB 2689/4885MAOA 3402/4885HRH3 96/4885
US-20090275554-A1 AMINOCARBOXYLIC ACID DERIVATIVE AND MEDICINAL USE THEREOF EDNRA, EDNRB, S1PR1 MAOB 1836/4885MAOA 1581/4885HRH3 938/4885

“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.