SCHEMBL25477709

SCHEMBL25477709

CC[C@@H](C)Cc1ccc2occc2c1

nearest known ligand 0.66

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR1B P28222 9/20 0.66
CYP2A6 P11509 2/20 0.39
CA2 P00918 2/20 0.38
CTNNB1 P35222 1/20 0.37
WNT3A P56704 1/20 0.37
DYRK1A Q13627 1/20 0.37
TAS1R3 Q7RTX0 1/20 0.36
TAS1R1 Q7RTX1 1/20 0.36
CHRNB4 P30926 1/20 0.36
CHRNA3 P32297 1/20 0.36
CHRNA7 P36544 1/20 0.36
CA12 O43570 1/20 0.36

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
SCHEMBL25477702 1.00 HTR1B (0.66) HTR1BCYP2A6CA2CTNNB1WNT3A
SCHEMBL25477690 1.00 HTR1B (0.66) HTR1BCYP2A6CA2CTNNB1WNT3A
SCHEMBL25477692 0.87 HTR1B (0.66) HTR1BCYP2A6
SCHEMBL25477711 0.87 HTR1B (0.66) HTR1BCYP2A6
SCHEMBL25477704 0.87 HTR1B (0.66) HTR1BCYP2A6
SCHEMBL13747619 0.85 HTR1B (0.68) HTR1BCYP2A6CA2CTNNB1WNT3A
SCHEMBL1602504 0.84 HTR1B (0.71) HTR1BCYP2A6CTNNB1WNT3ADYRK1A
SCHEMBL8008472 0.82 HTR1B (0.64) HTR1BCYP2A6CA2CTNNB1WNT3A
SCHEMBL25742643 0.82 HTR1B (0.64) HTR1BCYP2A6CA2CTNNB1WNT3A
SCHEMBL25237253 0.81 HTR1B (0.67) HTR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11767305-B2 Advantageous benzofuran compositions for mental disorders or enhancement TACTOGEN INC (US) 2023-09-26 US disclosed
US-20230150963-A1 ADVANTAGEOUS BENZOFURAN COMPOSITIONS FOR MENTAL DISORDERS OR ENHANCEMENT TACTOGEN INC. (US) 2023-05-18 US 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-11767305-B2 Advantageous benzofuran compositions for mental disorders or enhancement BDNF, CREBBP, ELF3 HTR1B 273/4885CYP2A6 884/4885CA2 4117/4885
US-20230150963-A1 ADVANTAGEOUS BENZOFURAN COMPOSITIONS FOR MENTAL DISORDERS OR ENHANCEMENT BDNF, CREBBP, ELF3 HTR1B 273/4885CYP2A6 884/4885CA2 4117/4885

“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.