SCHEMBL5740343

SCHEMBL5740343

CN1CCc2cccc3c4c(n(c23)CC1)CCCCC4

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 8/20 0.61
HTR2A P28223 8/20 0.61
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
TDP1 Q9NUW8 2/20 0.59
CYP2D6 P10635 2/20 0.59
HSD17B10 Q99714 2/20 0.59
KDM4E B2RXH2 1/20 0.59
TP53 P04637 1/20 0.59
CYP1A2 P05177 1/20 0.59
CYP3A4 P08684 1/20 0.59
MAPT P10636 1/20 0.59
CYP2C9 P11712 1/20 0.59
ALOX15 P16050 1/20 0.59
MAPK1 P28482 1/20 0.59
CYP2C19 P33261 1/20 0.59
ADRA2A P08913 4/20 0.53
ADRA2B P18089 4/20 0.53
ADRA2C P18825 4/20 0.53
HTR1D P28221 3/20 0.53

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
SCHEMBL5740154 0.99 HTR2C (0.60) HTR2CHTR2AMEN1KMT2ATDP1
SCHEMBL5739995 0.96 HTR2C (0.60) HTR2CHTR2AMEN1KMT2ATDP1
SCHEMBL3539313 0.90 HTR2C (0.69) HTR2CHTR2AMEN1KMT2ATDP1
SCHEMBL3542992 0.90 HTR2C (0.69) HTR2CHTR2AMEN1KMT2ATDP1
SCHEMBL3550600 0.85 HTR2C (0.68) HTR2CHTR2AMEN1KMT2ATDP1
SCHEMBL3545060 0.83 HTR2C (0.67) HTR2CHTR2AMEN1KMT2ATDP1
SCHEMBL5740261 0.80 HTR2A (0.50) HTR2CHTR2AMEN1KMT2ATDP1
SCHEMBL5740802 0.79 HTR2C (0.80) HTR2CHTR2AMEN1KMT2ATDP1
SCHEMBL5740142 0.78 HTR2C (0.43) HTR2CHTR2AMEN1KMT2ATDP1
SCHEMBL12457645 0.77 HTR2A (0.71) HTR2CHTR2AMEN1KMT2ATDP1

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
EP-1497296-B1 [1,4]DIAZOCINO[7,8,1-hi]INDOLE DERIVATIVES AS ANTIPSYCHOTIC AND ANTIOBESITY AGENTS WYETH CORP (US) 2006-03-22 EP claimed
US-7012089-B2 [1,4]Diazocino[7,8,1-hi]indole derivatives as antipsychotic and antiobesity agents WYETH (US) 2006-03-14 US claimed
US-20040034005-A1 [1,4]Diazocino[7,8,1-hi]indole derivatives as antipsychotic and antiobesity agents WYETH 2004-02-19 US claimed
EP-1497296-B1 [1,4]DIAZOCINO[7,8,1-hi]INDOLE DERIVATIVES AS ANTIPSYCHOTIC AND ANTIOBESITY AGENTS WYETH CORP (US) 2006-03-22 EP disclosed
US-7012089-B2 [1,4]Diazocino[7,8,1-hi]indole derivatives as antipsychotic and antiobesity agents WYETH (US) 2006-03-14 US disclosed
US-20040034005-A1 [1,4]Diazocino[7,8,1-hi]indole derivatives as antipsychotic and antiobesity agents WYETH 2004-02-19 US 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-20040034005-A1 [1,4]Diazocino[7,8,1-hi]indole derivatives as antipsychotic and antiobesity agents HTR1A, HTR2C, HTR1D HTR2C 2/4885HTR2A 9/4885MEN1 658/4885

“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.