SCHEMBL5633946

SCHEMBL5633946

c1cc2c3c(c1)C1CCCCCC1N3CCNC2

nearest known ligand 0.92

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 20/20 0.92
HTR2B P41595 7/20 0.57
HTR2A P28223 4/20 0.47

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
SCHEMBL5394177 1.00 HTR2C (0.92) HTR2CHTR2BHTR2A
SCHEMBL20698202 0.99 HTR2C (0.94) HTR2CHTR2BHTR2A
SCHEMBL7229772 0.99 HTR2C (0.94) HTR2CHTR2BHTR2A
SCHEMBL4344616 0.96 HTR2C (1.00) HTR2CHTR2BHTR2A
SCHEMBL16168362 0.96 HTR2C (1.00) HTR2CHTR2BHTR2A
SCHEMBL4352287 0.96 HTR2C (1.00) HTR2CHTR2BHTR2A
SCHEMBL29434863 0.96 HTR2C (1.00) HTR2CHTR2BHTR2A
SCHEMBL4354419 0.96 HTR2C (1.00) HTR2CHTR2BHTR2A
SCHEMBL5739640 0.86 HTR2C (0.73) HTR2CHTR2BHTR2A
SCHEMBL5739869 0.86 HTR2C (0.73) 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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7271164-B2 Cyclohepta[b][1,4]diazepino[6,7,1,-hi]indoles and derivatives WYETH (US) 2007-09-18 US claimed
US-20050054635-A1 Cyclohepta[b][1,4]diazepino[6,7,1,-hi]indoles and derivatives WYETH (US) 2005-03-10 US claimed
US-6858604-B2 Cyclohepta[b][1,4]diazepino[6,7,1-hi]indoles and derivatives WYETH (US) 2005-02-22 US claimed
US-20020128261-A1 Cyclohepta [b] [1,4] diazepino [6,7, 1-hi] indoles and derivatives AMERICAN HOME PRODUCTS CORPORATION 2002-09-12 US claimed
WO-2002036596-A2 CYCLOALKYL[b][1,4]DIAZEPINO[6,7,1-hi]INDOLES AND DERIVATIVES WYETH (US) 2002-05-10 WO claimed
US-7271164-B2 Cyclohepta[b][1,4]diazepino[6,7,1,-hi]indoles and derivatives WYETH (US) 2007-09-18 US disclosed
US-20050054635-A1 Cyclohepta[b][1,4]diazepino[6,7,1,-hi]indoles and derivatives WYETH (US) 2005-03-10 US disclosed
US-6858604-B2 Cyclohepta[b][1,4]diazepino[6,7,1-hi]indoles and derivatives WYETH (US) 2005-02-22 US disclosed
US-20020128261-A1 Cyclohepta [b] [1,4] diazepino [6,7, 1-hi] indoles and derivatives AMERICAN HOME PRODUCTS CORPORATION 2002-09-12 US disclosed
WO-2002036596-A2 CYCLOALKYL[b][1,4]DIAZEPINO[6,7,1-hi]INDOLES AND DERIVATIVES WYETH (US) 2002-05-10 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 (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-20020128261-A1 Cyclohepta [b] [1,4] diazepino [6,7, 1-hi] indoles and derivatives TPH1, HTR1A, FAAH HTR2C 14/4885HTR2B 5/4885HTR2A 23/4885
US-20050054635-A1 Cyclohepta[b][1,4]diazepino[6,7,1,-hi]indoles and derivatives TPH1, HTR1A, GRIN2B HTR2C 25/4885HTR2B 5/4885HTR2A 27/4885

“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.