SCHEMBL5329929

SCHEMBL5329929

c1ccc2c(C3OCCCO3)cccc2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.47
SLC6A4 P31645 6/20 0.44
SLC6A2 P23975 2/20 0.42
SLC6A3 Q01959 2/20 0.42
DRD2 P14416 1/20 0.41
PLA2G6 O60733 4/20 0.40
MAPK1 P28482 3/20 0.40
ALDH1A1 P00352 2/20 0.40
MAPT P10636 2/20 0.40
HPGD P15428 2/20 0.40
BLM P54132 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
MTNR1A P48039 1/20 0.40
FAAH O00519 1/20 0.40
NPC1 O15118 1/20 0.40
GMNN O75496 1/20 0.40
LMNA P02545 1/20 0.40
MTOR P42345 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL694466 0.92 KDM1A (0.50) KDM1ASLC6A4SLC6A2SLC6A3DRD2
SCHEMBL29117514 0.90 KDM1A (0.48) KDM1ASLC6A4SLC6A2SLC6A3DRD2
SCHEMBL5699414 0.84 KDM1A (0.50) KDM1ASLC6A4SLC6A2SLC6A3DRD2
SCHEMBL23375447 0.79 KDM1A (0.46) KDM1ASLC6A4SLC6A2SLC6A3DRD2
SCHEMBL18288002 0.79 HPGD (0.42) MAPK1ALDH1A1MAPTHPGDNPSR1
SCHEMBL31546135 0.78 MTNR1A (0.45) KDM1ASLC6A4SLC6A2SLC6A3DRD2
SCHEMBL30473345 0.78 SLC6A4 (0.50) KDM1ASLC6A4SLC6A2SLC6A3DRD2
SCHEMBL15890435 0.77 SMN1; SMN2 (0.52) KDM1ASLC6A4SLC6A2SLC6A3DRD2
SCHEMBL2032834 0.77 SLC6A4 (0.49) KDM1ASLC6A4SLC6A2SLC6A3DRD2
SCHEMBL4719316 0.76 ALDH1A1 (0.37) KDM1ASLC6A4SLC6A2SLC6A3PLA2G6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104311531-B A kind of 2,5-dinaphthyl alkane derivatives and preparation method thereof 山东盛华电子新材料有限公司 2016-08-24 CN claimed
CN-104558303-A Supported polypropylene catalyst and preparation method thereof PETROCHINA CO LTD 2015-04-29 CN claimed
JP-2019374-A None JP disclosed
US-20230340177-A1 COMPOSITION AND SILOXANE-BASED THERMOPLASTIC RESIN USING SAME, AND METHODS FOR PRODUCING SAME MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2023-10-26 US disclosed
US-20230340177-A1 COMPOSITION AND SILOXANE-BASED THERMOPLASTIC RESIN USING SAME, AND METHODS FOR PRODUCING SAME MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2023-10-26 US disclosed
US-20210403409-A1 METHOD FOR PRODUCING CARBONATE DERIVATIVE NATIONAL UNIVERSITY CORPORATION KOBE UNIVERSITY (JP) 2021-12-30 US disclosed
US-20210388159-A1 METHOD FOR PRODUCING POLYCARBONATE NATIONAL UNIVERSITY CORPORATION KOBE UNIVERSITY (JP) 2021-12-16 US disclosed
CN-104558303-B Supported polypropylene catalyst and preparation method thereof 中国石油天然气股份有限公司 2017-01-04 CN disclosed
CN-104311531-B A kind of 2,5-dinaphthyl alkane derivatives and preparation method thereof 山东盛华电子新材料有限公司 2016-08-24 CN disclosed
CN-104558303-A Supported polypropylene catalyst and preparation method thereof PETROCHINA CO LTD 2015-04-29 CN disclosed
JP-2007031373-A 2-NAPHTHYL-1,3-DIOXANE DERIVATIVE DAINIPPON INK & CHEM INC 2007-02-08 JP disclosed
JP-2006036719-A 2-NAPHTHYL-1,3-DIOXANE DERIVATIVE DAINIPPON INK & CHEM INC 2006-02-09 JP disclosed
JP-H0219374-A NAPTHO-M-DIOXAN BASED COMPOUND AND METHOD FOR PREVENTING FADING OF ORGANIC COLORED SUBSTANCE BY LIGHT USING ABOVE-MENTIONED COMPOUND KONICA CORP 1990-01-23 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-20210403409-A1 METHOD FOR PRODUCING CARBONATE DERIVATIVE CA4, CA3, CYP11B2 KDM1A 2195/4885SLC6A4 3811/4885SLC6A2 4764/4885

“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.