SCHEMBL5201541

SCHEMBL5201541

C1CCC(CNC2CCCC2)C1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 3/20 0.45
KDM4E B2RXH2 1/20 0.42
ADH1B P00325 1/20 0.42
ADH1C P00326 1/20 0.42
ADH1A P07327 1/20 0.42
ADH4 P08319 1/20 0.42
ADH7 P40394 1/20 0.42
CHRM2 P08172 1/20 0.42
CHRM4 P08173 1/20 0.42
CHRM5 P08912 1/20 0.42
ADRA2B P18089 1/20 0.42
ADRA2C P18825 1/20 0.42
MAN1B1 Q9UKM7 1/20 0.42
GLB1 P16278 1/20 0.39
LMNA P02545 1/20 0.38
TMEM97 Q5BJF2 3/20 0.38
ALDH1A1 P00352 1/20 0.38
HSD17B10 Q99714 1/20 0.38
HPGD P15428 1/20 0.38
KMT2A Q03164 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
SCHEMBL22790745 0.97 EPHX1 (0.48) EPHX1KDM4EADH1BADH1CADH1A
SCHEMBL21939606 0.97 ADH1B (0.46) EPHX1KDM4EADH1BADH1CADH1A
SCHEMBL21479462 0.97 ADH1B (0.46) EPHX1KDM4EADH1BADH1CADH1A
SCHEMBL23744926 0.97 EPHX1 (0.48) EPHX1KDM4EADH1BADH1CADH1A
SCHEMBL22802804 0.97 EPHX1 (0.48) EPHX1KDM4EADH1BADH1CADH1A
SCHEMBL24514269 0.97 EPHX1 (0.48) EPHX1KDM4EADH1BADH1CADH1A
SCHEMBL22790746 0.97 EPHX1 (0.48) EPHX1KDM4EADH1BADH1CADH1A
SCHEMBL24379883 0.97 EPHX1 (0.48) EPHX1KDM4EADH1BADH1CADH1A
SCHEMBL22899939 0.97 EPHX1 (0.48) EPHX1KDM4EADH1BADH1CADH1A
SCHEMBL22693050 0.97 EPHX1 (0.48) EPHX1KDM4EADH1BADH1CADH1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1737823-A2 NOVEL ALKYNE COMPOUNDS WITH AN MCH-ANTAGONISTIC ACTION AND MEDICAMENTS COMPRISING SAID COMPOUNDS Boehringer Ingelheim International GmbH (DE) 2007-01-03 EP claimed
WO-2005103002-A2 NOVEL ALKYNE COMPOUNDS WITH AN MCH-ANTAGONISTIC ACTION AND MEDICAMENTS COMPRISING SAID COMPOUNDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-11-03 WO claimed
US-20230149550-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE Design Therapeutics, Inc. 2023-05-18 US disclosed
US-RE47221-E1 Tricyclic compounds ABBVIE INC. (US) 2019-02-05 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 (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-20230149550-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE DMPK, DTYMK, MYCBP EPHX1 4547/4885KDM4E 1728/4885ADH1B 4081/4885

“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.