SCHEMBL30037019

SCHEMBL30037019

COc1c(I)cc(Cl)cc1C(=O)N[C@@H]1CN2CCC1CC2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR3A P46098 7/20 0.58
CYP2C9 P11712 2/20 0.58
CYP2C19 P33261 2/20 0.58
HTR3E A5X5Y0 1/20 0.58
HTR3B O95264 1/20 0.58
HTR5A P47898 1/20 0.58
HTR3D Q70Z44 1/20 0.58
HTR3C Q8WXA8 1/20 0.58
MEN1 O00255 1/20 0.58
CYP2D6 P10635 1/20 0.58
KMT2A Q03164 1/20 0.58
MAPK1 P28482 1/20 0.56
ALDH1A1 P00352 1/20 0.53
CYP1A2 P05177 1/20 0.53
CYP3A4 P08684 1/20 0.53
TSHR P16473 1/20 0.53
HTR2A P28223 1/20 0.53
SLC6A4 P31645 1/20 0.53
HRH1 P35367 1/20 0.53
PDE4D Q08499 1/20 0.53

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
SCHEMBL7358591 0.88 HTR3A (0.59) HTR3ACYP2C9CYP2C19HTR3EHTR3B
SCHEMBL7358583 0.88 HTR3A (0.59) HTR3ACYP2C9CYP2C19HTR3EHTR3B
SCHEMBL10436140 0.87 HTR3A (0.67) HTR3ACYP2C9CYP2C19HTR3EHTR3B
SCHEMBL7359887 0.81 HTR3A (0.55) HTR3ACYP2C9CYP2C19HTR3EHTR3B
SCHEMBL7362425 0.80 HTR3A (0.51) HTR3ACYP2C9CYP2C19HTR3EHTR3B
SCHEMBL2228529 0.80 HTR3A (0.69) HTR3ACYP2C9CYP2C19HTR3EHTR3B
SCHEMBL2228533 0.80 HTR3A (0.69) HTR3ACYP2C9CYP2C19HTR3EHTR3B
SCHEMBL7292105 0.80 HTR3A (0.69) HTR3ACYP2C9CYP2C19HTR3EHTR3B
SCHEMBL7362879 0.79 HTR3A (0.57) HTR3ACYP2C9CYP2C19HTR3EHTR3B
SCHEMBL7396664 0.79 HTR3A (0.55) HTR3ACYP2C9CYP2C19HTR3EHTR3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250163130-A1 LIGAND GATED ION CHANNELS AND METHODS OF USE SWITCH BIO, INC. 2025-05-22 US disclosed
US-20250152742-A1 COMPOSITIONS AND METHODS FOR NEUROLOGICAL DISEASES TRAMES BIO, INC. 2025-05-15 US disclosed
US-20240317834-A1 COMPOSITIONS AND METHODS FOR NEUROLOGICAL DISEASES TRAMES BIO, INC. 2024-09-26 US disclosed
US-20220348635-A1 COMPOSITIONS AND METHODS FOR NEUROLOGICAL DISEASES TRAMES BIO, INC. 2022-11-03 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 (4 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-20250152742-A1 COMPOSITIONS AND METHODS FOR NEUROLOGICAL DISEASES CHRNB2, CHRNA2, CHRNA6 HTR3A 1705/4885CYP2C9 4860/4885CYP2C19 4849/4885
US-20250163130-A1 LIGAND GATED ION CHANNELS AND METHODS OF USE CACNB2, CHRNA2, HCN3 HTR3A 975/4885CYP2C9 4837/4885CYP2C19 4842/4885
US-20240317834-A1 COMPOSITIONS AND METHODS FOR NEUROLOGICAL DISEASES CHRNB2, CHRNA2, CHRNA6 HTR3A 1705/4885CYP2C9 4860/4885CYP2C19 4849/4885
US-20220348635-A1 COMPOSITIONS AND METHODS FOR NEUROLOGICAL DISEASES CHRNB2, CHRNA2, CHRNA6 HTR3A 1705/4885CYP2C9 4860/4885CYP2C19 4849/4885

“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.