SCHEMBL547186

SCHEMBL547186

Cc1ccc2c(c1)-c1ccccc1C2

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.53
SMN1; SMN2 Q16637 4/20 0.53
MAPT P10636 3/20 0.53
HPGD P15428 2/20 0.53
KDM4E B2RXH2 2/20 0.53
RAB9A P51151 2/20 0.53
NPC1 O15118 1/20 0.53
LMNA P02545 1/20 0.53
PGR P06401 2/20 0.49
METAP1 P53582 1/20 0.48
SRD5A2 P31213 1/20 0.47
ELANE P08246 1/20 0.47
MAOA P21397 2/20 0.46
CYP1A2 P05177 3/20 0.46
ADRA2A P08913 1/20 0.46
SLC6A2 P23975 1/20 0.46
HTR2C P28335 1/20 0.46
SLC6A4 P31645 1/20 0.46
HTR2B P41595 1/20 0.46
CYP3A4 P08684 2/20 0.44

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
SCHEMBL31400232 0.91 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2MAPTHPGDKDM4E
SCHEMBL1609497 0.91 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2MAPTHPGDKDM4E
SCHEMBL546147 0.89 METAP1 (0.57) ALDH1A1SMN1; SMN2MAPTKDM4ERAB9A
SCHEMBL29633503 0.89 METAP1 (0.57) ALDH1A1SMN1; SMN2MAPTKDM4ERAB9A
SCHEMBL27913248 0.87 PARP1 (0.47) ALDH1A1SMN1; SMN2MAPTRAB9ANPC1
SCHEMBL21694418 0.86 METAP1 (0.52) ALDH1A1SMN1; SMN2MAPTHPGDKDM4E
SCHEMBL6905059 0.84 MAOA (0.67) ALDH1A1SMN1; SMN2MAPTHPGDKDM4E
SCHEMBL22738419 0.84 METAP1 (0.53) ALDH1A1SMN1; SMN2MAPTKDM4ERAB9A
SCHEMBL5016641 0.84 SMN1; SMN2 (0.64) ALDH1A1SMN1; SMN2MAPTHPGDKDM4E
SCHEMBL18582934 0.84 SMN1; SMN2 (0.64) ALDH1A1SMN1; SMN2MAPTHPGDKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6723743-B1 TREATING PATIENT SUFFERING FROM RHEUMATOID ARTHRITIS, PSORIASIS, BRONCHIAL ASTHMA, ALZHEIMER'S DISEASE, MYOCARDIAL INFARCTION OR ATHEROSCLEROSIS NEUROGEN CORPORATION 2004-04-20 US claimed
CN-118900820-A Liquid organohydrogen carrier compositions comprising a mixture of benzyltoluene isomers and methods of storing and releasing hydrogen using the same 汉阳大学校产学协力团 2024-11-05 CN disclosed
US-10640711-B2 Multistage thermolysis method for safe and efficient conversion of treated wood waste sources CHZ TECHNOLOGIES, LLC (US) 2020-05-05 US disclosed
EP-2570418-A2 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-03-20 EP disclosed
EP-1555267-B1 2,3-DIHYDRO-6-NITROIMIDAZO[2,1-b]OXAZOLES OTSUKA PHARMA CO LTD (JP) 2013-01-16 EP disclosed
US-8110294-B2 Fluorene compound; steric hindrance CANON KABUSHIKI KAISHA (JP) 2012-02-07 US disclosed
US-20080200736-A1 MATERIAL FOR ORGANIC LIGHT-EMITTING ELEMENT AND ORGANIC LIGHT-EMITTING ELEMENT INCLUDING THE SAME CANON KABUSHIKI KAISHA (JP) 2008-08-21 US disclosed
US-7262212-B2 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-08-28 US disclosed
US-20060094767-A1 2,3-Dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-05-04 US disclosed
EP-1555267-A1 2,3-DIHYDRO-6-NITROIMIDAZO 2,1-b OXAZOLES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2005-07-20 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 (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-20080200736-A1 MATERIAL FOR ORGANIC LIGHT-EMITTING ELEMENT AND ORGANIC LIGHT-EMITTING ELEMENT INCLUDING THE SAME LEF1, FMNL1, AFF1 ALDH1A1 319/4885SMN1; SMN2 2519/4885MAPT 917/4885
US-20060094767-A1 2,3-Dihydro-6-nitroimidazo[2,1-b]oxazoles NR2C2, NR4A3, NR4A2 ALDH1A1 355/4885SMN1; SMN2 3985/4885MAPT 4117/4885

“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.