SCHEMBL5255255

SCHEMBL5255255

CN1CCC(c2nn(S(=O)(=O)c3cccc(F)c3)c3ccccc23)C1

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 16/20 0.52
HTR2A P28223 2/20 0.46
HTR2C P28335 2/20 0.46
AKR1C3 P42330 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
SCHEMBL5253368 0.88 HTR6 (0.50) HTR6HTR2AHTR2C
SCHEMBL5252981 0.85 HTR2A (0.42) HTR6HTR2AHTR2C
SCHEMBL5252318 0.81 HTR6 (0.46) HTR6HTR2AHTR2C
Hydrochloric Acid SCHEMBL10395804 0.80 HTR6 (0.46) HTR6HTR2AHTR2C
SCHEMBL5253182 0.74 CNR1 (0.47) HTR6HTR2AHTR2C
SCHEMBL5256131 0.71 HTR6 (0.50) HTR6HTR2A
SCHEMBL4002900 0.71 CCR1 (0.49) HTR6
SCHEMBL10735901 0.70 CYP11B2 (0.47) HTR6HTR2AHTR2C
Hydrochloric Acid SCHEMBL10396437 0.70 CYP11B2 (0.47) HTR6HTR2AHTR2C
SCHEMBL1015115 0.68 HTR6 (0.55) HTR6HTR2AHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1355904-B1 HETEROCYCLINDAZOLE AND AZAINDAZOLE COMPOUNDS AS 5-HYDROXYTRYPTAMINE-6 LIGANDS WYETH CORP (US) 2007-08-01 EP claimed
EP-1803720-A1 Heterocyclindazole and -azaindazole compounds as 5-hydroxytryptamine-6 ligands Wyeth a Corporation of the State of Delaware (US) 2007-07-04 EP claimed
US-6767912-B2 SUCH AS 1-(PHENYLSULFONYL)-3-(PIPERIDIN-4-YL)-1H-INDAZOLE; FOR MOOD, MOTOR, OR COGNITIVE DISORDERS INCLUDING SCHIZOPHRENIA, ANXIETY, AND DEPRESSION WYETH 2004-07-27 US claimed
US-20040092526-A1 Heterocyclylindazole and -azaindazole compounds as 5-hydroxytryptamine-6 ligands WYETH 2004-05-13 US claimed
EP-1355904-A2 HETEROCYCLINDAZOLE AND AZAINDAZOLE COMPOUNDS AS 5-HYDROXYTRYPTAMINE-6 LIGANDS Wyeth (US) 2003-10-29 EP claimed
US-20020198213-A1 Heterocyclylindazole and -azaindazole compounds as 5-hydroxytryptamine-6 ligands AMERICAN HOME PRODUCTS CORPORATION 2002-12-26 US claimed
WO-2002051837-A2 HETEROCYCLINDAZOLE AND AZAINDAZOLE COMPOUNDS AS 5-HYDROXYTRYPTAMINE-6 LIGANDS WYETH (US) 2002-07-04 WO claimed
EP-1355904-B1 HETEROCYCLINDAZOLE AND AZAINDAZOLE COMPOUNDS AS 5-HYDROXYTRYPTAMINE-6 LIGANDS WYETH CORP (US) 2007-08-01 EP disclosed
EP-1803720-A1 Heterocyclindazole and -azaindazole compounds as 5-hydroxytryptamine-6 ligands Wyeth a Corporation of the State of Delaware (US) 2007-07-04 EP disclosed
US-20050124603-A1 Heterocyclylindazole and -azaindazole compounds as 5-hydroxytryptamine-6 ligands WYETH (US) 2005-06-09 US disclosed
US-6903112-B2 Heterocyclylindazole and -azaindazole compounds as 5-hydroxytryptamine-6 ligands WYETH (US) 2005-06-07 US disclosed
US-6767912-B2 SUCH AS 1-(PHENYLSULFONYL)-3-(PIPERIDIN-4-YL)-1H-INDAZOLE; FOR MOOD, MOTOR, OR COGNITIVE DISORDERS INCLUDING SCHIZOPHRENIA, ANXIETY, AND DEPRESSION WYETH 2004-07-27 US disclosed
US-20040092526-A1 Heterocyclylindazole and -azaindazole compounds as 5-hydroxytryptamine-6 ligands WYETH 2004-05-13 US disclosed
EP-1355904-A2 HETEROCYCLINDAZOLE AND AZAINDAZOLE COMPOUNDS AS 5-HYDROXYTRYPTAMINE-6 LIGANDS Wyeth (US) 2003-10-29 EP disclosed
US-20020198213-A1 Heterocyclylindazole and -azaindazole compounds as 5-hydroxytryptamine-6 ligands AMERICAN HOME PRODUCTS CORPORATION 2002-12-26 US disclosed
WO-2002051837-A2 HETEROCYCLINDAZOLE AND AZAINDAZOLE COMPOUNDS AS 5-HYDROXYTRYPTAMINE-6 LIGANDS WYETH (US) 2002-07-04 WO 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 (3 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-20040092526-A1 Heterocyclylindazole and -azaindazole compounds as 5-hydroxytryptamine-6 ligands HTR6, HTR5A, HTR1A HTR6 1/4885HTR2A 12/4885HTR2C 4/4885
US-20050124603-A1 Heterocyclylindazole and -azaindazole compounds as 5-hydroxytryptamine-6 ligands HTR6, HTR5A, HTR3B HTR6 1/4885HTR2A 10/4885HTR2C 4/4885
US-20020198213-A1 Heterocyclylindazole and -azaindazole compounds as 5-hydroxytryptamine-6 ligands HTR6, HTR5A, HTR1A HTR6 1/4885HTR2A 12/4885HTR2C 4/4885

“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.