SCHEMBL4676469

SCHEMBL4676469

CC1CN(c2cccc3[nH]c(S(=O)(=O)c4ccccc4)cc23)CC(C)N1

nearest known ligand 0.66

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 4/20 0.66
GHSR Q92847 15/20 0.40

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
SCHEMBL4675283 0.81 HTR6 (0.76) HTR6
SCHEMBL3326633 0.80 HTR6 (1.00) HTR6
Hydrochloric Acid SCHEMBL7008069 0.76 HTR6 (0.91) HTR6
SCHEMBL6548285 0.74 HTR6 (0.62) HTR6GHSR
SCHEMBL6549721 0.74 HTR6 (0.62) HTR6GHSR
SCHEMBL4676473 0.71 HTR6 (0.65) HTR6
SCHEMBL4309989 0.71 HTR6 (0.65) HTR6
SCHEMBL8960443 0.70 HTR6 (0.56) HTR6
SCHEMBL28797138 0.70 HTR6 (0.56) HTR6
Hydrochloric Acid SCHEMBL6047565 0.70 HTR6 (0.64) HTR6

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 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7449486-B2 Antiproliferative agents; anticancer agents; autoimmune disease; antiarthritic agents; graft versus host disease; inflammatory bowel disorders ARRAY BIOPHARMA INC. (US) 2008-11-11 US claimed
EP-1542973-B1 2,4-SUBSTITUTED INDOLES AND THEIR USE AS 5-HT6 MODULATORS HOFFMANN LA ROCHE (CH) 2008-07-30 EP claimed
CN-1301970-C 2, 4-substituted indoles and their use as 5-HT 6 modulators HOFFMANN LA ROCHE (CH) 2007-02-28 CN claimed
US-20060100161-A1 Antiproliferative agents; anticancer agents; autoimmune disease; antiarthritic agents; graft versus host disease; inflammatory bowel disorders ARRAY BIOPHARMA INC. 2006-05-11 US claimed
CN-1681783-A 2, 4-substituted indoles and their use as 5-HT 6 modulators HOFFMANN LA ROCHE (CH) 2005-10-12 CN claimed
EP-1542973-A1 2,4-SUBSTITUTED INDOLES AND THEIR USE AS 5-HT6 MODULATORS F. HOFFMANN-LA ROCHE AG (CH) 2005-06-22 EP claimed
WO-2004026831-A1 2,4-SUBSTITUTED INDOLES AND THEIR USE AS 5-HT6 MODULATORS F. HOFFMANN-LA ROCHE AG (CH) 2004-04-01 WO claimed
US-20180334441-A1 MITOTIC KINESIN INHIBITORS AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC. (US) 2018-11-22 US disclosed
US-10017482-B2 Mitotic kinesin inhibitors and methods of use thereof ARRAY BIOPHARMA INC. (US) 2018-07-10 US disclosed
US-20170066733-A1 MITOTIC KINESIN INHIBITORS AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC. (US) 2017-03-09 US disclosed
US-9499503-B2 Mitotic kinesin inhibitors and methods of use thereof ARRAY BIOPHARMA INC. (US) 2016-11-22 US disclosed
US-9102639-B2 Mitotic kinesin inhibitors and methods of use thereof ARRAY BIOPHARMA INC. (US) 2015-08-11 US disclosed
US-20150210658-A1 MITOTIC KINESIN INHIBITORS AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC. (US) 2015-07-30 US disclosed
US-7381739-B2 Antiserotonine agents; central nervous system disorders; Alzheimer's disease; Parkinson's disease; Huntington's disease; sleep disorders ROCHE PALO ALTO LLC (US) 2008-06-03 US disclosed
CN-1301970-C 2, 4-substituted indoles and their use as 5-HT 6 modulators HOFFMANN LA ROCHE (CH) 2007-02-28 CN disclosed
US-20060100161-A1 Antiproliferative agents; anticancer agents; autoimmune disease; antiarthritic agents; graft versus host disease; inflammatory bowel disorders ARRAY BIOPHARMA INC. 2006-05-11 US disclosed
CN-1681783-A 2, 4-substituted indoles and their use as 5-HT 6 modulators HOFFMANN LA ROCHE (CH) 2005-10-12 CN disclosed
EP-1542973-A1 2,4-SUBSTITUTED INDOLES AND THEIR USE AS 5-HT6 MODULATORS F. HOFFMANN-LA ROCHE AG (CH) 2005-06-22 EP disclosed
US-20040072844-A1 2,4-Substituted indoles and methods of use ROCHE PALO ALTO LLC 2004-04-15 US disclosed
WO-2004026831-A1 2,4-SUBSTITUTED INDOLES AND THEIR USE AS 5-HT6 MODULATORS F. HOFFMANN-LA ROCHE AG (CH) 2004-04-01 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 (6 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-20150210658-A1 MITOTIC KINESIN INHIBITORS AND METHODS OF USE THEREOF KIF5B, KIF2C, KIFC1 HTR6 4299/4885GHSR 4390/4885
US-20180334441-A1 MITOTIC KINESIN INHIBITORS AND METHODS OF USE THEREOF KIF5B, KIF18B, KIF18A HTR6 4470/4885GHSR 4494/4885
US-20060100161-A1 Antiproliferative agents; anticancer agents; autoimmune disease; antiarthritic agents; graft versus host disease; inflammatory bowel disorders KIF5B, KIF2C, KIFC1 HTR6 4707/4885GHSR 4355/4885
US-20040072844-A1 2,4-Substituted indoles and methods of use IDO1, IDO2, CYP4B1 HTR6 130/4885GHSR 960/4885
US-10017482-B2 Mitotic kinesin inhibitors and methods of use thereof KIF5B, KIF18B, KIF18A HTR6 4470/4885GHSR 4494/4885
US-20170066733-A1 MITOTIC KINESIN INHIBITORS AND METHODS OF USE THEREOF KIF5B, KIF18B, KIF18A HTR6 4470/4885GHSR 4494/4885

“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.