SCHEMBL6610074

SCHEMBL6610074

O=C(O)CCc1cc2ccc(N3CCNCC3)cc2[nH]1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR3E A5X5Y0 3/20 0.44
HTR3B O95264 3/20 0.44
HTR3A P46098 3/20 0.44
HTR3D Q70Z44 3/20 0.44
HTR3C Q8WXA8 3/20 0.44
SIGMAR1 Q99720 3/20 0.44
HTR5A P47898 1/20 0.44
USP2 O75604 1/20 0.42
ALDH1A1 P00352 1/20 0.42
TSHR P16473 1/20 0.42
HSD17B10 Q99714 1/20 0.42
ITGB3 P05106 2/20 0.41
ITGA2B P08514 2/20 0.41
DRD3 P35462 3/20 0.40
DRD2 P14416 2/20 0.40
DRD4 P21917 2/20 0.40
OPRL1 P41146 1/20 0.40
HTR1A P08908 3/20 0.39
HTR1D P28221 1/20 0.39
HTR1B P28222 1/20 0.39

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
SCHEMBL9474864 0.75 SLC16A3 (0.49) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL2302994 0.75 ITGB3 (0.61) HTR3EHTR3BHTR3AHTR3DHTR3C
Trifluoroacetic Acid SCHEMBL30355108 0.74 HTR3E (0.44) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL6607017 0.73 HTR6 (0.54) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL27771950 0.73 HTR3E (0.56) HTR3EHTR3BHTR3AHTR3DHTR3C
Propionic Acid SCHEMBL6610077 0.73 ALDH1A1 (0.46) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL27898242 0.72 ESRRG (0.44) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL23010850 0.72 ADRB1 (0.56) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL5637951 0.72 DAO (0.49) ALDH1A1TSHRHSD17B10CYP1A2CYP2C9
SCHEMBL16240933 0.72 EGFR (0.52) ALDH1A1TSHRHSD17B10

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
EP-1337528-B1 BENZOTHIOPHENE DERIVATIVE COMPOUNDS, PROCESS OF PREPARATION AND USE THEREOF VITA LAB (ES) 2004-08-04 EP disclosed
US-20040034219-A1 Benzothiophene derivative compounds process of preparation and use thereof LABORATORIOS VITA, S.A. (ES) 2004-02-19 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 (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-20040034219-A1 Benzothiophene derivative compounds process of preparation and use thereof TPH1, HTR1A, HTR5A HTR3E 19/4885HTR3B 8/4885HTR3A 5/4885

“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.