SCHEMBL5775017

SCHEMBL5775017

c1ccc(CN2CCc3c(ccnc3CN3CCCCC3)C2)cc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FAAH O00519 3/20 0.50
CACNA1B Q00975 1/20 0.46
HRH3 Q9Y5N1 5/20 0.45
HIF1A Q16665 2/20 0.45
ALDH1A1 P00352 2/20 0.45
HPGD P15428 2/20 0.45
KDM4E B2RXH2 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
CYP2C19 P33261 1/20 0.44
MEN1 O00255 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
KMT2A Q03164 1/20 0.43
PNMT P11086 1/20 0.43
HTT P42858 1/20 0.43
CLPP Q16740 1/20 0.42

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
SCHEMBL5777580 0.99 FAAH (0.51) FAAHCACNA1BHRH3HIF1AALDH1A1
SCHEMBL5778653 0.88 TMEM97 (0.50) FAAHHRH3ALDH1A1HPGDKDM4E
SCHEMBL5776677 0.83 FAAH (0.45) FAAH
SCHEMBL5775158 0.83 FAAH (0.48) FAAHALDH1A1HPGDKDM4EMEN1
SCHEMBL5774446 0.82 FAAH (0.46) FAAHMEN1NPC1RAB9AKMT2A
SCHEMBL5772604 0.81 FAAH (0.52) FAAHALDH1A1HPGDKDM4ENPSR1
SCHEMBL5774958 0.81 FAAH (0.49) FAAHALDH1A1HPGDKDM4EMEN1
SCHEMBL1549789 0.81 FAAH (0.56) FAAHALDH1A1HPGDKDM4EMEN1
SCHEMBL5777690 0.80 HRH3 (0.47) CACNA1BHRH3HIF1AALDH1A1HPGD
SCHEMBL11982568 0.79 FAAH (0.54) FAAHALDH1A1HPGDKDM4EMEN1

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
EP-1483257-B1 QUINAZOLINE COMPOUNDS USEFUL IN THERAPY PFIZER LTD (GB) 2006-09-13 EP disclosed
US-6936619-B2 Cardiovascular disorders; antilipemic agents; sexual disorders PFIZER, INC. (US) 2005-08-30 US disclosed
US-20040029859-A1 Compounds useful in therapy PFIZER INC. 2004-02-12 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-20040029859-A1 Compounds useful in therapy ADRA1D, HSD3B1, PTGER1 FAAH 23/4885CACNA1B 1093/4885HRH3 170/4885

“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.