SCHEMBL7260935

SCHEMBL7260935

O=C1c2ccccc2C(=O)N1CCCCCN1CCC(c2c[nH]c3ccccc23)CC1

nearest known ligand 0.94

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ADRA1D P25100 4/20 0.71
SLC6A4 P31645 2/20 0.70
HTR2A P28223 2/20 0.61
HTR7 P34969 2/20 0.61
HTR1A P08908 1/20 0.59
DRD2 P14416 1/20 0.59
HTR6 P50406 1/20 0.59

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
Hydrochloric Acid SCHEMBL7259962 0.99 ADRA1D (0.72) ADRA1DSLC6A4HTR2AHTR7DRD2
Hydrochloric Acid SCHEMBL7256791 0.99 ADRA1D (0.72) ADRA1DSLC6A4HTR2AHTR7DRD2
SCHEMBL5730515 0.99 ADRA1D (0.69) ADRA1DSLC6A4HTR2AHTR7HTR1A
Hydrochloric Acid SCHEMBL7261121 0.98 ADRA1D (0.70) ADRA1DSLC6A4HTR2AHTR7HTR1A
SCHEMBL6133590 0.97 ADRA1D (0.71) ADRA1DSLC6A4HTR2AHTR7
Hydrochloric Acid SCHEMBL7259035 0.96 ADRA1D (0.71) ADRA1DSLC6A4HTR2AHTR7
SCHEMBL9671736 0.92 HTR7 (0.67) ADRA1DSLC6A4HTR2AHTR7HTR1A
Hydrochloric Acid SCHEMBL7261098 0.91 HTR7 (0.66) ADRA1DSLC6A4HTR2AHTR7HTR1A
SCHEMBL5705223 0.88 CYP1A2 (0.56) ADRA1DSLC6A4HTR2AHTR7HTR1A
SCHEMBL7260967 0.86 ADRA1D (0.67) ADRA1DSLC6A4HTR2AHTR7HTR1A

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-6642228-B1 Treating ocular tension, carcinoma, sarcoma, tumentia, circulatory disease, or hypertension TORAY INDUSTRIES, INC. (JP) 2003-11-04 US disclosed
EP-1106605-A1 ALPHA1B-ADRENERGIC RECEPTOR ANTAGONISTS TORAY INDUSTRIES, INC. (JP) 2001-06-13 EP disclosed