SCHEMBL4879783

SCHEMBL4879783

O=C1Cn2c(cc3ccccc32)CN1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 5/20 0.53
HTR2C P28335 5/20 0.53
NOTUM Q6P988 1/20 0.44
HTR1A P08908 1/20 0.39
SIGMAR1 Q99720 10/20 0.38
ZAP70 P43403 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
SCHEMBL30684257 0.84 HTR2A (0.56) HTR2AHTR2CNOTUMHTR1ASIGMAR1
SCHEMBL10735669 0.84 HTR2A (0.56) HTR2AHTR2CNOTUMHTR1ASIGMAR1
SCHEMBL10830879 0.78 HTR2A (0.50) HTR2AHTR2CNOTUMHTR1ASIGMAR1
SCHEMBL34463390 0.74 NOTUM (0.56) HTR2AHTR2CNOTUMHTR1AZAP70
SCHEMBL7396809 0.74 NOTUM (0.56) HTR2AHTR2CNOTUMHTR1AZAP70
SCHEMBL13403405 0.74 NOTUM (0.47) HTR2AHTR2CNOTUMHTR1ASIGMAR1
SCHEMBL235219 0.72 NOTUM (0.59) HTR2AHTR2CNOTUMHTR1ASIGMAR1
SCHEMBL18911623 0.72 HTR2A (0.69) HTR2AHTR2CNOTUMHTR1ASIGMAR1
SCHEMBL6712342 0.71 HTR2A (0.58) HTR2AHTR2CNOTUMHTR1ASIGMAR1
SCHEMBL20777927 0.70 PIM1 (0.39) HTR2AHTR2CNOTUMHTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080226718-A1 Indole and Azaindole Derivatives For the Treatment of Inflammatory and Autoimmune Diseases BRANE DISCOVERY S.R.L (IT) 2008-09-18 US claimed
US-20070248672-A1 Indole and Azaindole Derivatives with Antitumor Action NIKEM RESEARCH S.R.L. (IT) 2007-10-25 US claimed
EP-1750687-A2 INDOLE AND AZAINDOLE DERIVATIVES WITH ANTITUMOR ACTION NIKEM RESEARCH S.R.L. (IT) 2007-02-14 EP claimed
WO-2005105213-A2 INDOLE AND AZAINDOLE DERIVATIVES WITH ANTITUMOR ACTION NIKEM RESEARCH S.R.L. (IT) 2005-11-10 WO claimed
US-20080226718-A1 Indole and Azaindole Derivatives For the Treatment of Inflammatory and Autoimmune Diseases BRANE DISCOVERY S.R.L (IT) 2008-09-18 US disclosed
US-20070248672-A1 Indole and Azaindole Derivatives with Antitumor Action NIKEM RESEARCH S.R.L. (IT) 2007-10-25 US disclosed
EP-1750687-A2 INDOLE AND AZAINDOLE DERIVATIVES WITH ANTITUMOR ACTION NIKEM RESEARCH S.R.L. (IT) 2007-02-14 EP disclosed
WO-2005105213-A2 INDOLE AND AZAINDOLE DERIVATIVES WITH ANTITUMOR ACTION NIKEM RESEARCH S.R.L. (IT) 2005-11-10 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-20070248672-A1 Indole and Azaindole Derivatives with Antitumor Action IDO1, IDO2, INMT HTR2A 131/4885HTR2C 484/4885NOTUM 3561/4885
US-20080226718-A1 Indole and Azaindole Derivatives For the Treatment of Inflammatory and Autoimmune Diseases IDO1, IDO2, INMT HTR2A 259/4885HTR2C 322/4885NOTUM 4021/4885

“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.