SCHEMBL7710792

SCHEMBL7710792

COc1ccc2[nH]cc(C3CCN(C)CC3)c2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1D P28221 4/20 0.67
HTR1B P28222 4/20 0.67
CYP1A2 P05177 1/20 0.67
CYP3A4 P08684 1/20 0.67
CYP2D6 P10635 1/20 0.67
CYP2C9 P11712 1/20 0.67
THPO P40225 1/20 0.67
MTNR1A P48039 1/20 0.61
MTNR1B P49286 1/20 0.61
HTR1A P08908 7/20 0.61
SLC6A4 P31645 6/20 0.61
APP P05067 1/20 0.60
HTR2A P28223 2/20 0.59
DRD2 P14416 1/20 0.59
HTR7 P34969 1/20 0.59
HTR6 P50406 1/20 0.59
HTR1F P30939 2/20 0.58
HTR2C P28335 1/20 0.58
HTR2B P41595 1/20 0.58
MAPT P10636 1/20 0.57

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
SCHEMBL25072243 0.92 MTNR1A (0.65) HTR1DHTR1BCYP1A2CYP3A4CYP2D6
SCHEMBL7020706 0.90 HTR1D (0.62) HTR1DHTR1BCYP1A2CYP3A4CYP2D6
SCHEMBL7489712 0.87 HTR1D (0.58) HTR1DHTR1BCYP1A2CYP3A4CYP2D6
SCHEMBL8209801 0.87 HTR1D (0.58) HTR1DHTR1BCYP1A2CYP3A4CYP2D6
SCHEMBL24736529 0.86 HTR2A (0.60) HTR1DHTR1BMTNR1AMTNR1BHTR1A
SCHEMBL24069043 0.86 MTNR1A (0.57) HTR1DHTR1BCYP1A2CYP3A4CYP2D6
SCHEMBL5363712 0.85 HTR1D (0.54) HTR1DHTR1BCYP1A2CYP3A4CYP2D6
SCHEMBL25758273 0.85 SLC6A4 (0.66) HTR1ASLC6A4HTR2ADRD2HTR7
SCHEMBL7478910 0.85 CYP1A2 (0.59) HTR1DHTR1BCYP1A2CYP3A4CYP2D6
SCHEMBL4677184 0.85 HTR1D (0.65) HTR1DHTR1BCYP1A2CYP3A4CYP2D6

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
US-20240376052-A1 N-SUBSTITUTED INDOLE DERIVATIVES AS SEROTONERGIC AGENTS USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO MINDSET PHARMA INC. (CA) 2024-11-14 US disclosed
US-20230212121-A1 SULFONAMIDE DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING SAME AS ACTIVE INGREDIENT FOR PREVENTING OR TREATING MENTAL ILLNESS TRINEURO (KR) 2023-07-06 US disclosed
WO-2023019366-A1 N-SUBSTITUTED INDOLE DERIVATIVES AS SEROTONERGIC AGENTS USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO MINDSET PHARMA INC. (CA) 2023-02-23 WO disclosed
WO-2023019368-A1 3-CYCLOAMINO-INDOLE COMPOUNDS AS SEROTONERGIC AGENTS USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO MINDSET PHARMA INC. (CA) 2023-02-23 WO disclosed
WO-2023019366-A1 N-SUBSTITUTED INDOLE DERIVATIVES AS SEROTONERGIC AGENTS USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO MINDSET PHARMA INC. (CA) 2023-02-23 WO disclosed
US-6358972-B1 FOR THERAPY OF MIGRAINE ELI LILLY AND COMPANY 2002-03-19 US disclosed
EP-1089993-A1 5-HT1F AGONISTS ELI LILLY AND COMPANY (US) 2001-04-11 EP disclosed
WO-2000000487-A1 5-HT1F AGONISTS ELI LILLY AND COMPANY (US) 2000-01-06 WO disclosed
WO-2000000490-A2 5-HT1F AGONISTS ELI LILLY AND COMPANY (US) 2000-01-06 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-20240376052-A1 N-SUBSTITUTED INDOLE DERIVATIVES AS SEROTONERGIC AGENTS USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO TPH1, HTR5A, TPH2 HTR1D 15/4885HTR1B 11/4885CYP1A2 161/4885
US-20230212121-A1 SULFONAMIDE DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING SAME AS ACTIVE INGREDIENT FOR PREVENTING OR TREATING MENTAL ILLNESS SLC6A2, SLC6A3, SLC6A4 HTR1D 59/4885HTR1B 70/4885CYP1A2 464/4885

“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.