SCHEMBL6977430

SCHEMBL6977430

COC(=O)CC(=O)CCc1nccn1C

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.40
FNTA P49354 1/20 0.40
FNTB P49356 1/20 0.40
PRMT5 O14744 1/20 0.39
WDR77 Q9BQA1 1/20 0.39
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.36
CNR2 P34972 1/20 0.36
NAMPT P43490 1/20 0.35
RAB9A P51151 2/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 2/20 0.34
F2RL1 P55085 1/20 0.34
NPC1 O15118 1/20 0.34
OPRK1 P41145 1/20 0.33
CASP3 P42574 1/20 0.33
SENP8 Q96LD8 1/20 0.33
SENP6 Q9GZR1 1/20 0.33

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
SCHEMBL2490033 0.89 FDPS (0.43) FDPSFNTAFNTBPRMT5WDR77
SCHEMBL7677314 0.87 FPR2 (0.38) FDPSFNTAFNTBPRMT5WDR77
SCHEMBL6979111 0.84 FNTA (0.44) FDPSFNTAFNTBPRMT5WDR77
SCHEMBL12530334 0.81 FDPS (0.44) FDPSFNTAFNTBPRMT5WDR77
SCHEMBL10830472 0.81 HPGD (0.42) FDPSFNTAFNTBMEN1KMT2A
SCHEMBL693477 0.77 FNTA (0.47) FDPSFNTAFNTBPRMT5WDR77
SCHEMBL17082712 0.77 FNTA (0.47) FDPSFNTAFNTBPRMT5WDR77
SCHEMBL6199476 0.77 CYP4F2 (0.44) FDPSFNTAFNTBMEN1KMT2A
SCHEMBL3396711 0.76 FDPS (0.49) FDPSFNTAFNTBPRMT5WDR77
Bromide SCHEMBL28813244 0.76 FNTA (0.46) FDPSFNTAFNTBPRMT5WDR77

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-20030176445-A1 Substituted 1,4-dihydropyridine compounds as bradykinin antagonists PFIZER INC. 2003-09-18 US disclosed
EP-1106615-B1 Substituted 1,4-dihydropyridine compounds as bradykinin antagonists PFIZER (US) 2003-03-05 EP disclosed
US-20020042421-A1 Substituted 1,4-dihydropyridine compounds as bradykinin antagonists OKUMURA YOSHIYUKI (JP) 2002-04-11 US disclosed
EP-1106615-A1 Substituted 1,4-dihydropyridine compounds as bradykinin antagonists PFIZER INC. (US) 2001-06-13 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 (2 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-20030176445-A1 Substituted 1,4-dihydropyridine compounds as bradykinin antagonists BDKRB1, BDKRB2, HRH4 FDPS 2223/4885FNTA 4447/4885FNTB 4313/4885
US-20020042421-A1 Substituted 1,4-dihydropyridine compounds as bradykinin antagonists BDKRB1, BDKRB2, HRH4 FDPS 1802/4885FNTA 4225/4885FNTB 3953/4885

“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.