SCHEMBL5584362

SCHEMBL5584362

Cc1cc(C2CCNCC2)sc1C

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 8/20 0.44
GABRA1 P14867 4/20 0.43
GABRG2 P18507 3/20 0.43
GABRB3 P28472 3/20 0.43
CHRM4 P08173 1/20 0.37
SLC18A3 Q16572 1/20 0.36
SIGMAR1 Q99720 1/20 0.36
MAPT P10636 1/20 0.36
THRB P10828 1/20 0.36
PLG P00747 3/20 0.35
QDPR P09417 1/20 0.35
GABRB2 P47870 1/20 0.34

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
SCHEMBL15443938 0.85 KDM4E (0.37) MAPT
SCHEMBL6968880 0.81 QDPR (0.44) HTR2CGABRA1GABRG2GABRB3CHRM4
SCHEMBL14571704 0.76 QDPR (0.41) HTR2CPLGQDPR
SCHEMBL5757274 0.72 HTR1A (0.40) HTR2CGABRA1GABRG2GABRB3CHRM4
SCHEMBL5758789 0.71 HTR2C (0.49) HTR2CSLC18A3SIGMAR1
SCHEMBL8818232 0.71 HTR2C (0.49) HTR2CGABRA1GABRG2GABRB3CHRM4
SCHEMBL6956559 0.69 HTR2C (0.46) HTR2CGABRA1GABRG2GABRB3CHRM4
SCHEMBL6989306 0.69 HTR2C (0.46) HTR2CGABRA1GABRB2
SCHEMBL5758221 0.68 HTR2C (0.46) HTR2CGABRA1GABRG2GABRB3
SCHEMBL5584924 0.68 HTR2C (0.46) HTR2CGABRA1GABRG2GABRB3SLC18A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7196199-B2 Antiserotonine agents; antidepressants MITSUBISHI PHARMA CORPORATION (JP) 2007-03-27 US disclosed
EP-1188747-B1 PHENOXYPROPYLAMINE COMPOUNDS MITSUBISHI PHARMA CORP (JP) 2005-09-07 EP disclosed
US-20040138227-A1 Phenoxypropylamine compounds NISHIYAMA AKIRA 2004-07-15 US disclosed
US-6720320-B2 ANTISEROTONINE AGENTS MITSUBISHI PHARMA CORPORATION (JP) 2004-04-13 US disclosed
US-20020111358-A1 Phenoxypropylamine compounds MITSUBISHI PHARMA CORPORATION (JP) 2002-08-15 US disclosed
EP-1188747-A1 PHENOXYPROPYLAMINE COMPOUNDS Mitsubishi Pharma Corporation (JP) 2002-03-20 EP 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 (2 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-20040138227-A1 Phenoxypropylamine compounds HTR1A, HTR1D, HTR5A HTR2C 9/4885GABRA1 410/4885GABRG2 1689/4885
US-20020111358-A1 Phenoxypropylamine compounds HTR1A, HTR1D, HTR5A HTR2C 9/4885GABRA1 410/4885GABRG2 1689/4885

“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.