SCHEMBL8316476

SCHEMBL8316476

CCCN(CCC)C1CCc2ccc3[nH]cc(C#N)c3c2C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR1D P28221 16/20 1.00
HTR1B P28222 14/20 1.00
HTR1A P08908 1/20 0.68
DRD2 P14416 2/20 0.67

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
SCHEMBL13533349 1.00 HTR1D (1.00) HTR1DHTR1BHTR1ADRD2
SCHEMBL8124390 0.91 HTR1D (0.83) HTR1DHTR1BHTR1ADRD2
SCHEMBL13534482 0.84 HTR1D (0.77) HTR1DHTR1BHTR1ADRD2
SCHEMBL8314559 0.84 HTR1D (1.00) HTR1DHTR1BHTR1ADRD2
SCHEMBL8312369 0.81 HTR1D (1.00) HTR1DHTR1BHTR1A
SCHEMBL8317482 0.81 HTR1D (0.74) HTR1DHTR1BHTR1ADRD2
SCHEMBL8887262 0.79 HTR1D (1.00) HTR1DHTR1BHTR1ADRD2
SCHEMBL7206145 0.78 HTR1A (0.65) HTR1DHTR1BHTR1ADRD2
SCHEMBL8784460 0.77 HTR1A (0.67) HTR1DHTR1BHTR1ADRD2
U-92,016-A SCHEMBL29462318 0.76 HTR1A (1.00) HTR1DHTR1BHTR1ADRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100009983-A1 5 HT RECEPTOR MEDIATED NEUROGENESIS BRAINCELLS, INC. (US) 2010-01-14 US disclosed
US-20100009983-A1 5 HT RECEPTOR MEDIATED NEUROGENESIS BRAINCELLS, INC. (US) 2010-01-14 US disclosed
EP-0510068-B1 NEW CENTRALLY ACTING 6,7,8,9-TETRAHYDRO-3H-BENZ(e)INDOLE HETEROCYCLICS UPJOHN CO (US) 1999-04-14 EP disclosed
US-5650427-A ANTIDEPRESSANTS THE UPJOHN COMPANY (US) 1997-07-22 US disclosed
US-5461061-A Antidepressants WIKSTROM HAKAN V (NL) 1995-10-24 US disclosed
US-5288748-A Antidepressants THE UPJOHN COMPANY (US) 1994-02-22 US disclosed
EP-0510068-A1 NEW CENTRALLY ACTING 6,7,8,9-TETRAHYDRO-3H-BENZ(e)INDOLE HETEROCYCLICS PHARMACIA & UPJOHN COMPANY (US) 1992-10-28 EP disclosed
WO-1991011435-A2 NEW CENTRALLY ACTING 6,7,8,9-TETRAHYDRO-3H-BENZ(e)INDOLE HETEROCYCLICS THE UPJOHN COMPANY (US) 1991-08-08 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 (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-20100009983-A1 5 HT RECEPTOR MEDIATED NEUROGENESIS HTR6, GAP43, HTR5A HTR1D 36/4885HTR1B 21/4885HTR1A 7/4885

“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.