SCHEMBL4736623

SCHEMBL4736623

CCCCCCCCCCOCCN1CC[N]CC1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.45
GNAO1 P09471 7/20 0.43
GNAI3 P08754 6/20 0.43
GNAI1 P63096 6/20 0.43
MEN1 O00255 1/20 0.41
THRB P10828 1/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 1/20 0.41
MAPT P10636 1/20 0.41
GBA2 Q9HCG7 4/20 0.37

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
SCHEMBL7508966 0.96 GNAO1 (0.47) LTA4HGNAO1GNAI3GNAI1MEN1
SCHEMBL7511056 0.95 GNAO1 (0.44) LTA4HGNAO1GNAI3GNAI1MEN1
SCHEMBL7510250 0.89 HRH3 (0.44) LTA4HGNAO1GNAI3GNAI1
SCHEMBL9042102 0.87 GNAI3 (0.37) GNAO1GNAI3GNAI1
SCHEMBL6553947 0.87 GNAI3 (0.53) LTA4HGNAO1GNAI3GNAI1MEN1
SCHEMBL7510266 0.85 KDM4E (0.34) LTA4HHTTMAPT
Bromide SCHEMBL28255534 0.85 GNAI3 (0.52) LTA4HGNAO1GNAI3GNAI1MEN1
SCHEMBL9433020 0.85 GNAO1 (0.55) GNAO1GNAI3GNAI1
SCHEMBL10773791 0.85 GNAO1 (0.55) GNAO1GNAI3GNAI1
SCHEMBL10593959 0.85 GNAO1 (0.55) GNAO1GNAI3GNAI1

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
WO-2008069726-A1 TREATMENT OF RESISTANT SCHIZOPHRENIA AND OTHER CNS DISORDERS BY THE USE OF THIOXANTHENES COPHARM (LU) 2008-06-12 WO claimed
US-20080139573-A1 Treatment of resistant Schizophrenia and other CNS disorders COPHARM (LU) 2008-06-12 US claimed
WO-2008069726-A1 TREATMENT OF RESISTANT SCHIZOPHRENIA AND OTHER CNS DISORDERS BY THE USE OF THIOXANTHENES COPHARM (LU) 2008-06-12 WO disclosed
US-20080139573-A1 Treatment of resistant Schizophrenia and other CNS disorders COPHARM (LU) 2008-06-12 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-20080139573-A1 Treatment of resistant Schizophrenia and other CNS disorders CHRNA10, SLC6A3, ZFX LTA4H 1838/4885GNAO1 591/4885GNAI3 1644/4885

“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.