SCHEMBL7652422

SCHEMBL7652422

O=S(=O)(c1cccnc1)N1CCC(N2CCc3ccccc3C2)CC1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.55
POLB P06746 2/20 0.54
HPGD P15428 1/20 0.51
GAA P10253 2/20 0.48
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.48
ALDH1A1 P00352 1/20 0.47
TSHR P16473 1/20 0.47
HSD17B10 Q99714 1/20 0.45
AKR1C3 P42330 1/20 0.45
MCOLN2 Q8IZK6 1/20 0.45
MCOLN3 Q8TDD5 1/20 0.45
MCOLN1 Q9GZU1 1/20 0.45
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL8179952 0.93 KDM4E (0.60) KDM4EPOLBHPGDGAAKMT2A
SCHEMBL7651531 0.87 GAA (0.51) KDM4EHPGDGAAKMT2AMEN1
SCHEMBL7646320 0.80 MEN1 (0.67) KDM4EPOLBHPGDGAAKMT2A
SCHEMBL7648688 0.79 KMT2A (0.50) KDM4EPOLBHPGDGAAKMT2A
SCHEMBL8187562 0.79 GAA (0.56) KDM4EGAAKMT2AMEN1ALDH1A1
SCHEMBL17007445 0.78 POLB (0.61) KDM4EPOLBHPGDGAAKMT2A
SCHEMBL7645943 0.78 GAA (0.46) KDM4EHPGDGAAKMT2AMEN1
SCHEMBL7647926 0.77 KMT2A (0.55) KDM4EPOLBHPGDGAAKMT2A
SCHEMBL7652256 0.76 MEN1 (0.72) POLBKMT2AMEN1ALDH1A1AKR1C3
SCHEMBL15014564 0.74 KDM4E (0.68) KDM4EPOLBHPGDKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20010041714-A1 5-HT7 receptor antagonists CAIN GARY A (US) 2001-11-15 US claimed
US-6486173-B2 SEROTONIN-7 (5-HT7); TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS SUCH AS SLEEP DISORDERS, DEPRESSION AND SCHIZOPHRENIA; FOR EXAMPLE 1,3-DIHYDRO-2-((4-(4-FLUOROPHENYL)-4-OXOBUTYL))ISOINDOLE BRISTOL-MYERS SQUIBB PHARMA COMPANY 2002-11-26 US disclosed
US-20010041714-A1 5-HT7 receptor antagonists CAIN GARY A (US) 2001-11-15 US disclosed
US-6239143-B1 TREATMENT CNS DISORDERS SUCH AS ANXIETY, DEPRESSION, SLEEP DISORDERS, AND SCHIZOPHRENIA. DUPONT PHARMACEUTICALS COMPANY 2001-05-29 US disclosed
WO-2000000472-A1 5-HT7 RECEPTOR ANTAGONISTS DU PONT PHARMACEUTICALS COMPANY (US) 2000-01-06 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-20010041714-A1 5-HT7 receptor antagonists HTR7, HTR5A, HTR1A KDM4E 3671/4885POLB 3434/4885HPGD 1560/4885

“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.