SCHEMBL6422828

SCHEMBL6422828

c1ccc2c(c1)SCC1CNCCN21

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 19/20 0.54
HTR2B P41595 17/20 0.54
HTR2A P28223 10/20 0.48
DRD2 P14416 1/20 0.44

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 SCHEMBL6422741 0.98 HTR2C (0.52) HTR2CHTR2BHTR2ADRD2
SCHEMBL31244723 0.77 HTR2A (0.58) HTR2CHTR2BHTR2A
SCHEMBL4482120 0.76 KMT2A (0.49) HTR2CHTR2BHTR2A
SCHEMBL5322262 0.72 HTR2C (0.73) HTR2CHTR2BHTR2ADRD2
SCHEMBL1366067 0.72 HTR2C (0.73) HTR2CHTR2BHTR2ADRD2
SCHEMBL692120 0.71 HTR2C (0.69) HTR2CHTR2BHTR2ADRD2
SCHEMBL30729380 0.71 MEN1 (0.64) HTR2CHTR2BHTR2ADRD2
SCHEMBL3260203 0.71 MEN1 (0.64) HTR2CHTR2BHTR2ADRD2
SCHEMBL7975273 0.71 HTR2C (0.52) HTR2CHTR2BHTR2A
SCHEMBL3265754 0.70 HTR2C (1.00) HTR2CHTR2BHTR2A

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-1057814-B1 TETRAHYDROBENZINDOLE DERIVATIVES MEIJI SEIKA KAISHA (JP) 2005-03-09 EP disclosed
US-6498251-B1 Tetrahydrobenzindole derivatives MEIJI SEIKA KAISHA, LTD. (JP) 2002-12-24 US disclosed
US-6407112-B1 2A,3,4,5-TETRAHYDRO-1H-BENZ(CD)INDOL-2-ONE DERIVATIVES; 5-HYDROXYTRYPTAMINE AGONISTS; SLEEP, CIRCADIAN RHYTHYM, BIPOLAR, AND PSYCHOLOGICAL DISORDER TREATMENT MEIJI SEIKA KAISHA, LTD. (JP) 2002-06-18 US disclosed
EP-1081136-A1 OPTICALLY ACTIVE TETRAHYDROBENZINDOLE DERIVATIVES Meiji Seika Kaisha, Ltd. (JP) 2001-03-07 EP disclosed
EP-1057814-A1 TETRAHYDROBENZINDOLE DERIVATIVES Meiji Seika Kaisha, Ltd. (JP) 2000-12-06 EP disclosed