SCHEMBL7653024

SCHEMBL7653024

Fc1ccc(C2(CCCN3Cc4ccccc4C3)OCCO2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.47
HSD17B10 Q99714 1/20 0.47
HTR1A P08908 8/20 0.43
DRD2 P14416 8/20 0.43
HTR7 P34969 8/20 0.43
HTR2B P41595 7/20 0.43
HTR2A P28223 6/20 0.43
DRD3 P35462 6/20 0.43
HRH1 P35367 4/20 0.43
SLC6A4 P31645 1/20 0.43
HTR5A P47898 1/20 0.43
CYP1A2 P05177 2/20 0.40
CYP2D6 P10635 2/20 0.40
CYP2C19 P33261 2/20 0.40
ALDH1A1 P00352 1/20 0.40
GRIN1 Q05586 1/20 0.39
GRIN2B Q13224 1/20 0.39
HTR2C P28335 1/20 0.37
SIGMAR1 Q99720 2/20 0.36
CCR1 P32246 1/20 0.35

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
SCHEMBL7653473 0.91 HTR7 (0.56) HTR1ADRD2HTR7HTR2BHTR2A
SCHEMBL7653427 0.86 ALDH1A1 (0.40) KDM4EHSD17B10HTR1ADRD2HTR7
SCHEMBL7647683 0.86 ALDH1A1 (0.43) KDM4EHTR1ADRD2HTR7HTR2B
SCHEMBL11818822 0.78 DRD2 (0.39) HTR1ADRD2HTR7HTR2BHTR2A
SCHEMBL9766000 0.78 SIGMAR1 (0.50) HTR1ADRD2HTR7HTR2BHTR2A
SCHEMBL7646399 0.76 POLB (0.47) HSD17B10HTR1AALDH1A1
SCHEMBL7297558 0.76 CCR3 (0.53) SLC6A4SIGMAR1
SCHEMBL11855986 0.75 HTR1A (0.49) HTR1ADRD2HTR7HTR2BHTR2A
SCHEMBL10854731 0.74 CCR5 (0.39) HTR1ADRD3GRIN1GRIN2B
SCHEMBL10827113 0.74 ACHE (0.56) KDM4EHTR1ADRD2HTR7HTR2B

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-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

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 3671/4885HSD17B10 2715/4885HTR1A 3/4885

“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.