SCHEMBL14907374

SCHEMBL14907374

CCCCCCCCCCNCCc1c[nH]c2ccc(O)cc12

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 8/20 0.69
HTR1D P28221 3/20 0.65
HTR1A P08908 1/20 0.65
HTR1B P28222 1/20 0.65
MPO P05164 3/20 0.65
KDM4E B2RXH2 3/20 0.65
CYP2D6 P10635 2/20 0.65
HTR2C P28335 2/20 0.65
MEN1 O00255 1/20 0.65
KMT2A Q03164 1/20 0.65
ALDH1A1 P00352 2/20 0.60
NPSR1 Q6W5P4 2/20 0.60
SPR P35270 2/20 0.60
CYP1A2 P05177 1/20 0.60
CYP3A4 P08684 1/20 0.60
MAPT P10636 1/20 0.60
IDO1 P14902 1/20 0.60
HPGD P15428 1/20 0.60
BLM P54132 1/20 0.60
NOTUM Q6P988 1/20 0.60

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
SCHEMBL27514454 1.00 TRPV1 (0.69) TRPV1HTR1DHTR1AHTR1BMPO
SCHEMBL23630278 1.00 TRPV1 (0.69) TRPV1HTR1DHTR1AHTR1BMPO
SCHEMBL25076891 1.00 TRPV1 (0.69) TRPV1HTR1DHTR1AHTR1BMPO
SCHEMBL23633206 1.00 TRPV1 (0.69) TRPV1HTR1DHTR1AHTR1BMPO
SCHEMBL25076703 1.00 TRPV1 (0.69) TRPV1HTR1DHTR1AHTR1BMPO
SCHEMBL23633204 1.00 TRPV1 (0.69) TRPV1HTR1DHTR1AHTR1BMPO
SCHEMBL23630275 1.00 TRPV1 (0.69) TRPV1HTR1DHTR1AHTR1BMPO
SCHEMBL25076884 1.00 TRPV1 (0.69) TRPV1HTR1DHTR1AHTR1BMPO
SCHEMBL25076883 1.00 TRPV1 (0.69) TRPV1HTR1DHTR1AHTR1BMPO
SCHEMBL453066 0.99 TRPV1 (0.67) TRPV1HTR1DHTR1AHTR1BMPO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024008341-A1 SEROTONIN ANALOGUES FOR USE IN TREATING METALLOPTOSIS-ASSOCIATED DISORDERS INSTITUT CURIE (FR) 2024-01-11 WO disclosed
WO-2023021112-A1 NOVEL SEROTONIN DERIVATIVES AND THEIR USES FOR TREATING IRON-ASSOCIATED DISORDERS CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2023-02-23 WO disclosed
US-20150306077-A1 Novel Compositions and Methods for Treating Cancer BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2015-10-29 US disclosed
US-20150306077-A1 Novel Compositions and Methods for Treating Cancer BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2015-10-29 US disclosed
US-9073851-B2 Compositions and methods for treating cancer BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2015-07-07 US disclosed
US-9073851-B2 Compositions and methods for treating cancer BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2015-07-07 US disclosed
US-20130129812-A1 NOVEL COMPOSITIONS AND METHODS FOR TREATING CANCER BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2013-05-23 US disclosed
US-20130129812-A1 NOVEL COMPOSITIONS AND METHODS FOR TREATING CANCER BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2013-05-23 US disclosed
WO-2013063492-A1 NOVEL COMPOSITIONS AND METHODS FOR TREATING CANCER BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2013-05-02 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-20150306077-A1 Novel Compositions and Methods for Treating Cancer HDGF, HCCS, CCNC TRPV1 2188/4885HTR1D 1044/4885HTR1A 152/4885
US-20130129812-A1 NOVEL COMPOSITIONS AND METHODS FOR TREATING CANCER HDGF, HCCS, CCNC TRPV1 2188/4885HTR1D 1044/4885HTR1A 152/4885

“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.