SCHEMBL6806756

SCHEMBL6806756

CCCCOc1ccc(S(C)(=O)=O)cc1C(=O)Nc1c(CC)nn(Cc2ccccn2)c1C(N)=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.38
RXFP1 Q9HBX9 4/20 0.37
TERT O14746 2/20 0.37
IRAK4 Q9NWZ3 1/20 0.35
WDR5 P61964 1/20 0.35
HPGD P15428 1/20 0.35
HSD17B10 Q99714 1/20 0.35
ALDH1A1 P00352 1/20 0.34
HTT P42858 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
PDE5A O76074 1/20 0.34
S1PR3 Q99500 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
GAA P10253 1/20 0.33
PNKP Q96T60 1/20 0.33
LMNA P02545 2/20 0.33
BLM P54132 1/20 0.33
MAPK1 P28482 1/20 0.33
RAB9A P51151 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
SCHEMBL6799966 0.96 POLB (0.38) POLBRXFP1TERTIRAK4HPGD
SCHEMBL6811243 0.94 POLB (0.40) POLBRXFP1TERTIRAK4HPGD
SCHEMBL6806204 0.90 POLB (0.38) POLBRXFP1TERTIRAK4ALDH1A1
SCHEMBL6808158 0.81 SLC6A9 (0.35) POLBTERTIRAK4LMNABLM
SCHEMBL6802097 0.77 PDE5A (0.36) POLBRXFP1IRAK4ALDH1A1HTT
SCHEMBL6801848 0.76 TERT (0.37) TERTPDE5ALMNABLM
SCHEMBL6806862 0.74 POLB (0.40) POLBRXFP1IRAK4ALDH1A1HTT
SCHEMBL6332580 0.71 PDE5A (0.57) POLBRXFP1ALDH1A1PDE5AKMT2A
SCHEMBL6633712 0.71 SLC6A9 (0.37) TERTIRAK4LMNABLM
SCHEMBL6806762 0.70 RXFP1 (0.38) RXFP1TERTHSD17B10PDE5AS1PR3

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-6770645-B2 SEXUAL DISORDERS THERAPY; ANTIALLERGENS; RESPIRATORY SYSTEM DISORDERS PFIZER INC. 2004-08-03 US disclosed
US-20030064990-A1 Pharmaceutically active compounds PFIZER INC. 2003-04-03 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-20030064990-A1 Pharmaceutically active compounds PDE5A, PDE3A, PDE2A POLB 1558/4885RXFP1 47/4885TERT 2924/4885

“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.