SCHEMBL3442011

SCHEMBL3442011

Cc1noc(NC(=O)N2CCN(c3ccc(-c4ccccc4)cc3)CC2)c1C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 6/20 0.52
ME2 P23368 1/20 0.48
ME1 P48163 1/20 0.48
ME3 Q16798 1/20 0.48
GLA P06280 1/20 0.47
HTR1A P08908 1/20 0.47
HTR1D P28221 1/20 0.47
HTR1B P28222 1/20 0.47
HTR2A P28223 1/20 0.47
HTR2C P28335 1/20 0.47
HTR6 P50406 1/20 0.47
TRPV1 Q8NER1 1/20 0.47
EDNRB P24530 1/20 0.46
EDNRA P25101 1/20 0.46
FAAH O00519 2/20 0.46
MEN1 O00255 2/20 0.46
POLB P06746 2/20 0.46
KMT2A Q03164 2/20 0.46
MAPT P10636 2/20 0.46
HCRTR1 O43613 1/20 0.46

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
SCHEMBL3442740 0.90 USP2 (0.52) DGAT1EDNRBEDNRAFAAHMEN1
SCHEMBL3269073 0.87 FAAH (0.42) DGAT1HTR1AHTR1DHTR1BHTR2A
SCHEMBL3442445 0.87 DGAT1 (0.49) DGAT1TRPV1EDNRBEDNRAFAAH
SCHEMBL3268557 0.84 FAAH (0.46) DGAT1TRPV1FAAHMEN1POLB
SCHEMBL3442676 0.83 KDM4E (0.48) DGAT1TRPV1FAAHPOLBMAPT
SCHEMBL3268330 0.82 FAAH (0.52) DGAT1TRPV1FAAHMAPT
SCHEMBL3269594 0.80 FAAH (0.48) DGAT1TRPV1FAAHMAPTUSP2
SCHEMBL3268193 0.80 FAAH (0.50) TRPV1FAAH
SCHEMBL3765680 0.80 FAAH (0.73) FAAH
SCHEMBL3778588 0.80 AR (0.52) FAAHMEN1KMT2AMAPTHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7812025-B2 Brain/neuronal cell-protecting agent and therapeutic agent for sleep disorder TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-10-12 US claimed
US-20090048263-A1 Brain/neuronal cell-protecting agent and therapeutic agent for sleep disorder TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-02-19 US claimed
EP-1923388-A1 BRAIN/NEURONAL CELL-PROTECTING AGENT, AND THERAPEUTIC AGENT FOR SLEEP DISORDER Takeda Pharmaceutical Company Limited (JP) 2008-05-21 EP claimed
US-7812025-B2 Brain/neuronal cell-protecting agent and therapeutic agent for sleep disorder TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-10-12 US disclosed
US-20090048263-A1 Brain/neuronal cell-protecting agent and therapeutic agent for sleep disorder TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-02-19 US disclosed
EP-1923388-A1 BRAIN/NEURONAL CELL-PROTECTING AGENT, AND THERAPEUTIC AGENT FOR SLEEP DISORDER Takeda Pharmaceutical Company Limited (JP) 2008-05-21 EP 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-20090048263-A1 Brain/neuronal cell-protecting agent and therapeutic agent for sleep disorder HCRTR1, HCRTR2, MTNR1A DGAT1 2871/4885ME2 1061/4885ME1 3404/4885

“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.