SCHEMBL15322872

SCHEMBL15322872

CN1CCC(=CCC(=O)O)CC1

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPT P10636 2/20 0.33
ADORA1 P30542 1/20 0.33
RAD52 P43351 1/20 0.33
SETD7 Q8WTS6 1/20 0.32
CYP2D6 P10635 1/20 0.32
ALOX15 P16050 1/20 0.32
OPRD1 P41143 1/20 0.32
CYP3A4 P08684 1/20 0.32
HTT P42858 1/20 0.32
HRH3 Q9Y5N1 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.31
TDP1 Q9NUW8 2/20 0.31
CYP1A2 P05177 1/20 0.31
KMT2A Q03164 2/20 0.31
POLB P06746 2/20 0.31
MEN1 O00255 1/20 0.31

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
SCHEMBL9432293 0.74 ALDH1A1 (0.38) ALDH1A1CYP2D6ALOX15HTTPOLB
SCHEMBL10894325 0.74 ALDH1A1 (0.38) ALDH1A1CYP2D6ALOX15HTTPOLB
SCHEMBL6947992 0.74 ESR2 (0.36) KDM4ESETD7HRH3
SCHEMBL10891992 0.74 ALDH1A1 (0.38) ALDH1A1CYP2D6ALOX15HTTPOLB
SCHEMBL5516168 0.73 ALDH1A1 (0.33) ALDH1A1CYP2D6ALOX15
SCHEMBL25404223 0.72 ALDH1A1 (0.36) ALDH1A1CYP2D6ALOX15
SCHEMBL8325073 0.72 CYP3A4 (0.37) KDM4EALDH1A1MAPTADORA1RAD52
SCHEMBL12972268 0.72 HRH3 (0.36) SETD7HRH3
SCHEMBL24131684 0.70 HRH3 (0.35) HRH3
SCHEMBL6947677 0.70 NOS1 (0.35) HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3815685-A2 COMPOUND COMPRISING A MAO TARGETING/SEEKER MOIETY FOR TREATING HUMAN GLIOMAS The Methodist Hospital Research Institute (US) 2021-05-05 EP disclosed
US-10555936-B2 Chemotherapeutic compositions and methods for treating human gliomas THE METHODIST HOSPITAL (US) 2020-02-11 US disclosed
EP-2804604-A1 COMPOUND COMPRISING A MAO TARGETING/ SEEKER MOIETY FOR TREATING HUMAN GLIOMAS The Methodist Hospital Research Institute (US) 2014-11-26 EP disclosed
US-20140323513-A1 Chemotherapeutic Compositions and Methods for Treating Human Gliomas THE METHODIST HOSPITAL 2014-10-30 US disclosed
WO-2013151584-A1 COMPOUND COMPRISING A MAO TARGETING/ SEEKER MOIETY FOR TREATING HUMAN GLIOMAS THE METHODIST HOSPITAL RESEARCH INSTITUTE (US) 2013-10-10 WO 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-10555936-B2 Chemotherapeutic compositions and methods for treating human gliomas TK2, IDH2, COX5B KDM4E 1789/4885ALDH1A1 500/4885MAPT 1201/4885
US-20140323513-A1 Chemotherapeutic Compositions and Methods for Treating Human Gliomas TK2, IDH2, COX5B KDM4E 1789/4885ALDH1A1 500/4885MAPT 1201/4885

“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.