SCHEMBL8124161

SCHEMBL8124161

O=S(=O)(c1ccc2cc(Cl)ccc2c1)N1CCN(CC2CCN(c3ccncc3)CC2)CC1

nearest known ligand 0.69

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F10 P00742 17/20 0.69
HTR7 P34969 2/20 0.61
HTR6 P50406 2/20 0.61
TPSAB1 Q15661 1/20 0.61

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
SCHEMBL8120701 0.90 TPSAB1 (0.74) F10HTR7HTR6TPSAB1
SCHEMBL8112377 0.88 TPSAB1 (0.61) F10HTR7HTR6TPSAB1
Hydrochloric Acid SCHEMBL7052281 0.86 F10 (0.62) F10HTR7HTR6TPSAB1
SCHEMBL2469023 0.85 F10 (0.61) F10HTR7HTR6TPSAB1
Hydrochloric Acid SCHEMBL6897689 0.85 F10 (0.61) F10HTR7HTR6TPSAB1
SCHEMBL8122049 0.83 F10 (0.61) F10HTR7HTR6
SCHEMBL8120962 0.82 F10 (0.63) F10
SCHEMBL8122092 0.82 F10 (0.57) F10HTR7HTR6
SCHEMBL8119105 0.82 F10 (0.49) F10HTR7HTR6TPSAB1
SCHEMBL1387192 0.82 F10 (1.00) F10

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-1048652-A1 AROMATIC COMPOUNDS HAVING CYCLIC AMINO OR SALTS THEREOF MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2000-11-02 EP claimed
EP-1048652-A1 AROMATIC COMPOUNDS HAVING CYCLIC AMINO OR SALTS THEREOF MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2000-11-02 EP disclosed