SCHEMBL693557

SCHEMBL693557

C1=C(C2CCCCCC2)CCCC1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.48
MAPT P10636 1/20 0.36
HSD11B1 P28845 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
NPC1 O15118 1/20 0.33
EPHX1 P07099 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CCR2 P41597 1/20 0.32
HIF1A Q16665 1/20 0.32
TLR4 O00206 1/20 0.31
NUDT1 P36639 1/20 0.30
BACE1 P56817 1/20 0.30

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
SCHEMBL9479135 1.00 KDM1A (0.48) KDM1AMAPTHSD11B1HDAC1HDAC2
SCHEMBL123151 1.00 KDM1A (0.48) KDM1AMAPTHSD11B1HDAC1HDAC2
SCHEMBL216035 1.00 KDM1A (0.48) KDM1AMAPTHSD11B1HDAC1HDAC2
SCHEMBL8361882 1.00 KDM1A (0.48) KDM1AMAPTHSD11B1HDAC1HDAC2
SCHEMBL20552191 1.00 KDM1A (0.48) KDM1AMAPTHSD11B1HDAC1HDAC2
SCHEMBL235344 1.00 KDM1A (0.48) KDM1AMAPTHSD11B1HDAC1HDAC2
SCHEMBL6682662 1.00 KDM1A (0.48) KDM1AMAPTHSD11B1HDAC1HDAC2
SCHEMBL5699292 1.00 KDM1A (0.48) KDM1AMAPTHSD11B1HDAC1HDAC2
SCHEMBL1053630 1.00 KDM1A (0.48) KDM1AMAPTHSD11B1HDAC1HDAC2
SCHEMBL11552545 1.00 KDM1A (0.48) KDM1AMAPTHSD11B1HDAC1HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023227695-A1 NEW DERIVATIVES FOR TREATING TRPM3 MEDIATED DISORDERS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2023-11-30 WO disclosed
WO-2023227697-A1 NEW DERIVATIVES FOR TREATING TRPM3 MEDIATED DISORDERS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2023-11-30 WO disclosed
WO-2023227696-A1 NEW DERIVATIVES FOR TREATING TRPM3 MEDIATED DISORDERS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2023-11-30 WO disclosed
WO-2023227698-A1 NEW DERIVATIVES FOR TREATING TRPM3 MEDIATED DISORDERS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2023-11-30 WO disclosed
CN-117136061-A SIK inhibitors and methods of use thereof 索尔特戈公司 2023-11-28 CN disclosed
CN-116997548-A HTT modulators for the treatment of huntington's disease CHDI基金会股份有限公司 2023-11-03 CN disclosed
EP-2448600-B1 COMPOUNDS TARGETING THE CATION-INDEPENDENT MANNOSE 6-PHOSPHATE RECEPTOR INSERM INST NAT DE LA SANTÉ ET DE LA RECH MÉDICALE (FR) 2016-03-30 EP disclosed
US-8962573-B2 Compounds targeting the cation-independent mannose 6-phosphate receptor INSERM (INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE) (FR) 2015-02-24 US disclosed
EP-2448600-A1 COMPOUNDS TARGETING THE CATION-INDEPENDENT MANNOSE 6-PHOSPHATE RECEPTOR INSERM - Institut National de la Santé et de la Recherche Médicale (FR) 2012-05-09 EP disclosed
US-20120093795-A1 COMPOUNDS TARGETING THE CATION-INDEPENDENT MANNOSE 6-PHOSPHATE RECEPTOR INSERM (INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE) (FR) 2012-04-19 US disclosed
EP-2422817-A1 Flavin-nucleic acid ligand conjugates INSERM (Institut National de la Santé et de la Recherche Médicale) (FR) 2012-02-29 EP disclosed
WO-2011000958-A1 COMPOUNDS TARGETING THE CATION-INDEPENDENT MANNOSE 6-PHOSPHATE RECEPTOR INSERM (Institut National de la Santé et de la Recherche Médicale) (FR) 2011-01-06 WO disclosed
US-7241884-B2 Porphines-platinum metal complex compounds for organic electroluminescent device and organic electroluminescent device using them LG ELECTRONICS INC. (KR) 2007-07-10 US disclosed
US-20050137394-A1 Porphines-platinum metal complex compounds for organic electroluminescent device and organic electroluminescent device using them LG ELECTRONICS INC. (KR) 2005-06-23 US disclosed
US-20030220400-A1 Enantiomerically pure basic arylcycloalkylhydroxycarboxylic esters, processes for their preparation and their use in medicaments Noe, Christian 2003-11-27 US disclosed
US-6613795-B2 Respiratory system disorders; muscle relaxants Noe, Christian (DE) 2003-09-02 US disclosed
US-20020173536-A1 Enantiomerically pure basic arylcycloalkylhydroxycarboxylic esters, processes for their preparation and their use in medicaments CHRISTIAN NOE AND ERNST MUTSCHLER 2002-11-21 US disclosed
US-6307060-B1 ANTISPASMODIC AGENTS Noe, Christian 2001-10-23 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 (4 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-20120093795-A1 COMPOUNDS TARGETING THE CATION-INDEPENDENT MANNOSE 6-PHOSPHATE RECEPTOR M6PR, IGF2R, MPI KDM1A 4514/4885MAPT 2860/4885HSD11B1 3387/4885
US-20020173536-A1 Enantiomerically pure basic arylcycloalkylhydroxycarboxylic esters, processes for their preparation and their use in medicaments CYP2A13, CYP3A43, HCAR2 KDM1A 2857/4885MAPT 4510/4885HSD11B1 159/4885
US-20050137394-A1 Porphines-platinum metal complex compounds for organic electroluminescent device and organic electroluminescent device using them PPOX, FECH, PYCR1 KDM1A 1803/4885MAPT 2311/4885HSD11B1 3826/4885
US-20030220400-A1 Enantiomerically pure basic arylcycloalkylhydroxycarboxylic esters, processes for their preparation and their use in medicaments CYP2A13, CYP3A43, HCAR2 KDM1A 2857/4885MAPT 4510/4885HSD11B1 159/4885

“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.