SCHEMBL6695065

SCHEMBL6695065

CN1CCN(c2ncccc2-c2ccc(Cn3ccc4cc(Br)ccc43)cc2)CC1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 2/20 0.45
PPARG P37231 1/20 0.40
ELANE P08246 3/20 0.39
USP1 O94782 2/20 0.39
METAP2 P50579 2/20 0.39
HTR3E A5X5Y0 2/20 0.38
HTR3B O95264 2/20 0.38
HTR3A P46098 2/20 0.38
HTR3D Q70Z44 2/20 0.38
HTR3C Q8WXA8 2/20 0.38
HRH4 Q9H3N8 2/20 0.38
HTT P42858 1/20 0.36
HTR1A P08908 1/20 0.36
HTR2C P28335 1/20 0.36

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
SCHEMBL6692106 0.89 HTR3E (0.41) ELANEUSP1METAP2HTR3EHTR3B
SCHEMBL6700742 0.89 PTGDR2 (0.43) HTR7ELANEUSP1METAP2HTR3E
SCHEMBL6700106 0.87 KMT2A (0.46) ELANEUSP1HTR3EHTR3BHTR3A
SCHEMBL6693288 0.84 HTR7 (0.48) HTR7PPARGHTR1AHTR2C
SCHEMBL6226643 0.82 HTR3E (0.42) ELANEUSP1METAP2HTR3EHTR3B
SCHEMBL6224819 0.77 CYP1A2 (0.43) ELANEUSP1METAP2HTR3EHTR3B
SCHEMBL6225287 0.76 BRD4 (0.45) METAP2HRH4HTT
SCHEMBL6696187 0.75 USP1 (0.44) PPARGELANEUSP1METAP2HTR3E
SCHEMBL6223653 0.75 CYP11B1 (0.54) ELANEHTR3EHTR3BHTR3AHTR3D
SCHEMBL6249947 0.74 BRD4 (0.44) METAP2HRH4HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040229874-A1 5HT7 Antagonists and inverse agonists PFIZER INC. 2004-11-18 US claimed
US-20040229874-A1 5HT7 Antagonists and inverse agonists PFIZER INC. 2004-11-18 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-20040229874-A1 5HT7 Antagonists and inverse agonists HTR7, HTR1A, HTR1B HTR7 1/4885PPARG 1245/4885ELANE 4713/4885

“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.