SCHEMBL7516300

SCHEMBL7516300

Nc1nc(-c2ccc(F)cc2)c(C2CCN(CCCC(=O)c3ccc(F)cc3)C2)s1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 1.00
DRD4 P21917 1/20 1.00
DRD2 P14416 3/20 0.53
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
CHRM2 P08172 1/20 0.52
HTR1A P08908 1/20 0.52
ADRA2A P08913 1/20 0.52
DRD1 P21728 1/20 0.52
ADRA1A P35348 1/20 0.52
OPRM1 P35372 1/20 0.52
DRD3 P35462 1/20 0.52
KCNH2 Q12809 1/20 0.52
HRH3 Q9Y5N1 1/20 0.52
CYP2D6 P10635 1/20 0.48
TSHR P16473 1/20 0.46

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
SCHEMBL6907364 1.00 HTR2A (1.00) HTR2ADRD4DRD2MEN1KMT2A
Hydrochloric Acid SCHEMBL8552262 0.99 HTR2A (0.98) HTR2ADRD4DRD2MEN1KMT2A
Bromide SCHEMBL8553366 0.95 HTR2A (0.91) HTR2ADRD4DRD2MEN1KMT2A
SCHEMBL8552863 0.93 HTR2A (0.87) HTR2ADRD4DRD2MEN1KMT2A
SCHEMBL3726273 0.89 HTR2A (0.79) HTR2ADRD4DRD2MEN1KMT2A
SCHEMBL13041313 0.86 DRD4 (0.75) HTR2ADRD4DRD2MEN1KMT2A
SCHEMBL8552184 0.76 DRD4 (0.61) HTR2ADRD4DRD2MEN1KMT2A
SCHEMBL8558550 0.75 HTR2A (0.59) HTR2ADRD4DRD2
SCHEMBL8556407 0.74 DRD4 (0.59) HTR2ADRD4MEN1KMT2ATSHR
SCHEMBL8553513 0.74 HTR2A (0.59) HTR2ADRD4DRD2HTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020094986-A1 Combination treatment for depression, anxiety and psychosis PFIZER INC 2002-07-18 US disclosed
EP-1213031-A2 Combination treatment for depression, anxiety and psychosis comprising an antidepressant and/or anxiolytic and a D4 receptor antagonist Pfizer Products Inc. (US) 2002-06-12 EP disclosed
EP-0816362-A1 THIAZOLE DERIVATIVES TAISHO PHARMACEUTICAL CO. LTD (JP) 1998-01-07 EP 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-20020094986-A1 Combination treatment for depression, anxiety and psychosis HTR4, CHRNA4, GRM4 HTR2A 63/4885DRD4 4/4885DRD2 6/4885

“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.