SCHEMBL5771733

SCHEMBL5771733

c1ccc(CN2CCc3c(ccnc3NCc3ccccn3)C2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 4/20 0.57
ALDH1A1 P00352 4/20 0.43
KDM4E B2RXH2 3/20 0.43
LMNA P02545 1/20 0.43
GAA P10253 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MAPT P10636 3/20 0.42
ALOX15 P16050 2/20 0.42
CASP1 P29466 2/20 0.42
CASP7 P55210 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
HSD17B10 Q99714 2/20 0.42
USP2 O75604 1/20 0.42
ESR1 P03372 1/20 0.42
RUNX1 Q01196 1/20 0.42
CBFB Q13951 1/20 0.42
CFTR P13569 1/20 0.42
SIGMAR1 Q99720 1/20 0.41
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41

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
SCHEMBL5777548 0.90 FAAH (0.61) FAAHALDH1A1KDM4ELMNAGAA
SCHEMBL5776362 0.79 FAAH (0.55) FAAHALDH1A1KDM4EMAPTALOX15
SCHEMBL5777641 0.77 NPC1 (0.49) KDM4ELMNASMN1; SMN2MAPTHSD17B10
SCHEMBL1549789 0.77 FAAH (0.56) FAAHALDH1A1KDM4EGAAMAPT
SCHEMBL1550179 0.75 FAAH (0.52) FAAHALDH1A1KDM4EGAAMAPT
SCHEMBL3943345 0.75 FAAH (0.70) FAAHLMNASMN1; SMN2MAPTUSP2
SCHEMBL1921426 0.74 FAAH (0.54) FAAHALDH1A1KDM4EGAAMAPT
SCHEMBL11982568 0.74 FAAH (0.54) FAAHALDH1A1KDM4EGAAMAPT
SCHEMBL30104821 0.74 FAAH (0.54) FAAHMEN1NPC1RAB9AKMT2A
SCHEMBL3932572 0.74 FAAH (0.54) FAAHALDH1A1KDM4ELMNAGAA

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 23/4885ALDH1A1 1113/4885KDM4E 2413/4885

“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.