SCHEMBL6154077

SCHEMBL6154077

O=S(=O)(c1ccccc1)N1CCC2(CC1)OCCO2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 1.00
KDM4E B2RXH2 1/20 0.77
ALDH1A1 P00352 4/20 0.69
MAPK1 P28482 2/20 0.69
KMT2A Q03164 2/20 0.69
MEN1 O00255 1/20 0.69
L3MBTL1 Q9Y468 1/20 0.69
PKM P14618 1/20 0.62
CYP2D6 P10635 1/20 0.59
TSHR P16473 1/20 0.58
USP2 O75604 2/20 0.56
CYP1A2 P05177 2/20 0.56
CYP3A4 P08684 2/20 0.56
CYP2C9 P11712 1/20 0.56
CYP2C19 P33261 1/20 0.56
SMN1; SMN2 Q16637 2/20 0.55
LMNA P02545 1/20 0.55
ATM Q13315 1/20 0.55

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
SCHEMBL12939705 0.86 POLB (0.74) POLBKDM4EALDH1A1MAPK1KMT2A
SCHEMBL12793323 0.85 KDM4E (0.79) POLBKDM4EALDH1A1MAPK1KMT2A
SCHEMBL4009309 0.84 KDM4E (0.77) POLBKDM4EALDH1A1MAPK1KMT2A
SCHEMBL2080837 0.84 KDM4E (0.77) POLBKDM4EALDH1A1MAPK1L3MBTL1
SCHEMBL2831202 0.84 KDM4E (0.77) POLBKDM4EALDH1A1MAPK1L3MBTL1
SCHEMBL5306415 0.84 POLB (1.00) POLBKDM4EALDH1A1KMT2APKM
SCHEMBL12386397 0.84 KDM4E (0.77) POLBKDM4EALDH1A1MAPK1L3MBTL1
SCHEMBL4008490 0.83 POLB (0.71) POLBKDM4EALDH1A1MAPK1KMT2A
SCHEMBL13182556 0.81 POLB (0.68) POLBKDM4EALDH1A1MAPK1KMT2A
SCHEMBL12386392 0.80 KDM4E (0.71) POLBKDM4EALDH1A1MAPK1KMT2A

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-20050182040-A1 Benzamide derivatives DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2005-08-18 US disclosed
EP-1500643-A1 BENZAMIDE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2005-01-26 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 (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-20050182040-A1 Benzamide derivatives ROCK1, ROCK2, NHERF1 POLB 4155/4885KDM4E 2017/4885ALDH1A1 2454/4885

“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.