SCHEMBL6313399

SCHEMBL6313399

CN1CCN(c2cccc3ccc(Oc4ncccn4)cc23)CC1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 12/20 0.69
HTR1D P28221 10/20 0.69
HTR1B P28222 10/20 0.69
SLC6A9 P48067 1/20 0.51
KCNH2 Q12809 1/20 0.51
MTNR1B P49286 1/20 0.48
RAB9A P51151 1/20 0.46
ADRB2 P07550 2/20 0.45
ADRB1 P08588 2/20 0.45
ADRA2A P08913 2/20 0.45
DRD2 P14416 2/20 0.45
ADRA2B P18089 2/20 0.45
ADRA2C P18825 2/20 0.45
DRD1 P21728 2/20 0.45
DRD4 P21917 2/20 0.45
SLC6A2 P23975 2/20 0.45
HRH2 P25021 2/20 0.45
ADRA1D P25100 2/20 0.45
HTR2A P28223 2/20 0.45
HTR2C P28335 2/20 0.45

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
SCHEMBL8187543 0.88 HTR1A (0.63) HTR1AHTR1DHTR1BSLC6A9KCNH2
SCHEMBL8187985 0.85 HTR1A (0.60) HTR1AHTR1DHTR1BSLC6A9KCNH2
SCHEMBL6000211 0.84 HTR1A (0.75) HTR1AHTR1DHTR1BSLC6A9KCNH2
SCHEMBL6314228 0.81 HTR1A (0.59) HTR1AHTR1DHTR1BSLC6A9KCNH2
SCHEMBL8566993 0.80 HTR1A (0.73) HTR1AHTR1DHTR1BSLC6A9KCNH2
SCHEMBL7803791 0.80 HTR1A (0.69) HTR1AHTR1DHTR1BSLC6A9KCNH2
SCHEMBL8187439 0.79 HTR1A (0.61) HTR1AHTR1DHTR1BSLC6A9KCNH2
SCHEMBL7812619 0.78 HTR1A (0.73) HTR1AHTR1DHTR1BSLC6A9KCNH2
SCHEMBL1387940 0.78 HTR6 (0.46) HTR1AHTR1DHTR1BMTNR1BRAB9A
SCHEMBL27371183 0.78 HTR1A (0.65) HTR1AHTR1DHTR1BSLC6A9KCNH2

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050080090-A1 Naphthalene derivatives CHENARD BERTRAND L (US) 2005-04-14 US claimed
US-20020058811-A1 Naphthalene derivatives CHENARD BERTRAND L (US) 2002-05-16 US claimed
US-20010004669-A1 Pyrazinyl-substituted naphthalene derivatives CHENARD BERTRAND L (US) 2001-06-21 US claimed
EP-0689536-B1 NAPHTHALENE DERIVATIVES PFIZER (US) 2001-05-23 EP claimed
EP-0701819-B1 Novel compositions containing sertraline and a 5-HT1D receptor agonist or antagonist PFIZER (US) 2000-08-16 EP claimed
EP-0795328-A1 Use of naphthalene derivatives in treating lung carcinoma PFIZER INC. (US) 1997-09-17 EP claimed
EP-0701819-A2 Novel compositions containing sertraline and a 5-HT1D receptor agonist or antagonist PFIZER INC. (US) 1996-03-20 EP claimed
EP-0689536-A1 NAPHTHALENE DERIVATIVES PFIZER INC. (US) 1996-01-03 EP claimed
WO-1994021619-A1 NAPHTHALENE DERIVATIVES PFIZER INC. (US) 1994-09-29 WO claimed
WO-2020183011-A1 HTR1D INHIBITORS AND USES THEREOF IN THE TREATMENT OF CANCER INSTITUT CURIE (FR) 2020-09-17 WO disclosed
US-20050080090-A1 Naphthalene derivatives CHENARD BERTRAND L (US) 2005-04-14 US disclosed
US-20020058811-A1 Naphthalene derivatives CHENARD BERTRAND L (US) 2002-05-16 US disclosed
US-20010004669-A1 Pyrazinyl-substituted naphthalene derivatives CHENARD BERTRAND L (US) 2001-06-21 US disclosed
EP-0689536-B1 NAPHTHALENE DERIVATIVES PFIZER (US) 2001-05-23 EP disclosed
EP-0767782-A1 ARYL AND HETEROARYL ALKOXYNAPHTHALENE DERIVATIVES PFIZER INC. (US) 1997-04-16 EP disclosed
US-5597826-A Compositions containing sertraline and a 5-HT1D receptor agonist or antagonist PFIZER INC. (US) 1997-01-28 US disclosed
EP-0701819-A2 Novel compositions containing sertraline and a 5-HT1D receptor agonist or antagonist PFIZER INC. (US) 1996-03-20 EP disclosed
WO-1996000720-A1 ARYL AND HETEROARYL ALKOXYNAPHTHALENE DERIVATIVES PFIZER INC. (US) 1996-01-11 WO disclosed
EP-0689536-A1 NAPHTHALENE DERIVATIVES PFIZER INC. (US) 1996-01-03 EP disclosed
WO-1994021619-A1 NAPHTHALENE DERIVATIVES PFIZER INC. (US) 1994-09-29 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 (3 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-20010004669-A1 Pyrazinyl-substituted naphthalene derivatives HTR4, HCRTR2, CNR2 HTR1A 13/4885HTR1D 22/4885HTR1B 10/4885
US-20050080090-A1 Naphthalene derivatives HTR4, NPY4R, HCRTR1 HTR1A 9/4885HTR1D 21/4885HTR1B 12/4885
US-20020058811-A1 Naphthalene derivatives HTR4, CNR1, CNR2 HTR1A 10/4885HTR1D 18/4885HTR1B 11/4885

“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.