SCHEMBL3620708

SCHEMBL3620708

Cc1ccccc1S(=O)(=O)n1cc(OC(=O)C(F)(F)F)c2c(CN3CCCC3)cccc21

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 18/20 0.44
HTR2C P28335 1/20 0.37
ALDH1A1 P00352 2/20 0.37
GAA P10253 2/20 0.37
TSHR P16473 1/20 0.37
KDM4E B2RXH2 1/20 0.37
ATM Q13315 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL3620079 0.88 HTR6 (0.42) HTR6ALDH1A1TSHRKDM4ENPSR1
SCHEMBL3624427 0.88 HTR6 (0.48) HTR6HTR2C
SCHEMBL3622706 0.87 HTR6 (0.52) HTR6ALDH1A1KDM4ETDP1
SCHEMBL3611319 0.86 HTR6 (0.55) HTR6ALDH1A1GAA
SCHEMBL3617274 0.85 HTR6 (0.52) HTR6ALDH1A1KDM4ETDP1
SCHEMBL3618821 0.84 HTR6 (0.44) HTR6ALDH1A1GAATSHR
SCHEMBL3618926 0.84 HTR6 (0.56) HTR6ALDH1A1KDM4ETDP1
SCHEMBL3626399 0.83 HTR6 (0.47) HTR6ALDH1A1NPSR1
SCHEMBL3620061 0.83 HTR6 (0.45) HTR6ALDH1A1GAAKDM4E
SCHEMBL3616454 0.83 HTR6 (0.47) HTR6ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2046741-B1 INDOLES AS 5-HT6 MODULATORS PROXIMAGEN LTD (GB) 2012-10-31 EP disclosed
US-7812017-B2 4-substituted indole and indoline compounds BIOVITRUM AB (PUBL.) (SE) 2010-10-12 US disclosed
EP-2046741-A1 INDOLES AS 5-HT6 MODULATORS BIOVITRUM AB (publ) (SE) 2009-04-15 EP disclosed
US-20080032968-A1 New compounds PROXIMAGEN NEUROSCIENCE PLC (GB) 2008-02-07 US disclosed
WO-2008003703-A1 INDOLES AS 5-HT6 MODULATORS BIOVITRUM AB (PUBL) (SE) 2008-01-10 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 (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-20080032968-A1 New compounds HTR6, HTR1B, HTR1A HTR6 1/4885HTR2C 15/4885ALDH1A1 917/4885

“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.