SCHEMBL7090777

SCHEMBL7090777

FC(F)(F)c1ccc(SCCCN2CCN(c3cccc4[nH]ccc34)CC2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 7/20 0.56
DRD3 P35462 7/20 0.56
HTR1A P08908 4/20 0.56
HTR2A P28223 4/20 0.56
GOT1 P17174 3/20 0.52
DRD4 P21917 1/20 0.49
GAA P10253 3/20 0.47
MAPT P10636 1/20 0.46
ADRB1 P08588 1/20 0.44
HTR6 P50406 1/20 0.44
ADRA1A P35348 1/20 0.44
DRD1 P21728 3/20 0.43
DRD5 P21918 3/20 0.43
MEN1 O00255 1/20 0.42
GFER P55789 1/20 0.42
KMT2A Q03164 1/20 0.42
ADRA2C P18825 1/20 0.41
HTR7 P34969 1/20 0.41
HRH1 P35367 1/20 0.41
SIGMAR1 Q99720 1/20 0.40

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
SCHEMBL7094831 0.87 GOT1 (0.55) DRD2DRD3HTR1AHTR2AGOT1
SCHEMBL5114321 0.85 GOT1 (0.46) DRD2DRD3HTR1AHTR2AGOT1
SCHEMBL7093713 0.84 DRD2 (0.60) DRD2DRD3HTR1AGOT1DRD4
SCHEMBL7093414 0.83 DRD2 (0.51) DRD2DRD3HTR1AHTR2AGOT1
SCHEMBL5118022 0.83 GOT1 (0.46) DRD2DRD3HTR1AHTR2AGOT1
SCHEMBL7094842 0.82 DRD2 (0.54) DRD2DRD3HTR1AHTR2AGOT1
SCHEMBL7094232 0.82 GAA (0.52) DRD2DRD3GOT1DRD4GAA
SCHEMBL7096669 0.82 GAA (0.53) DRD2DRD3HTR1AHTR2AGOT1
SCHEMBL7090545 0.80 DRD2 (0.50) DRD2DRD3HTR1AGOT1DRD4
SCHEMBL7093564 0.80 DRD2 (0.53) DRD2DRD3HTR1AGOT1DRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030050307-A1 Novel indole derivatives H. LUNDBECK A/S (DK) 2003-03-13 US claimed
US-20030050307-A1 Novel indole derivatives H. LUNDBECK A/S (DK) 2003-03-13 US disclosed
EP-1246818-A1 NOVEL INDOLE DERIVATIVES H. LUNDBECK A/S (DK) 2002-10-09 EP disclosed
WO-2001049680-A1 NOVEL INDOLE DERIVATIVES H. LUNDBECK A/S (DK) 2001-07-12 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 (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-20030050307-A1 Novel indole derivatives HTR1A, HTR3C, HTR2C DRD2 27/4885DRD3 25/4885HTR1A 1/4885

“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.