SCHEMBL6345485

SCHEMBL6345485

C1=C(c2ccc(-c3ccccc3)cc2)CCCC1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ACMSD Q8TDX5 2/20 0.50
PTGS2 P35354 1/20 0.47
TDP1 Q9NUW8 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
SIGMAR1 Q99720 1/20 0.42
ELANE P08246 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HTR2C P28335 1/20 0.41
MAT2A P31153 1/20 0.39
TAAR1 Q96RJ0 2/20 0.39
HDAC3 O15379 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC2 Q92769 1/20 0.39
SERPINE1 P05121 1/20 0.38
CHRNB4 P30926 1/20 0.38
CHRNA3 P32297 1/20 0.38

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
SCHEMBL8380044 0.95 ACMSD (0.49) ACMSDPTGS2TDP1MEN1KMT2A
SCHEMBL191429 0.95 ACMSD (0.49) ACMSDPTGS2TDP1MEN1KMT2A
SCHEMBL8360447 0.93 ACMSD (0.47) ACMSDPTGS2TDP1MEN1KMT2A
SCHEMBL1109744 0.93 ACMSD (0.47) ACMSDPTGS2TDP1MEN1KMT2A
SCHEMBL8356129 0.93 ACMSD (0.47) ACMSDPTGS2TDP1MEN1KMT2A
SCHEMBL1094676 0.93 ACMSD (0.47) ACMSDPTGS2TDP1MEN1KMT2A
SCHEMBL1109745 0.93 ACMSD (0.47) ACMSDPTGS2TDP1MEN1KMT2A
SCHEMBL1109740 0.93 ACMSD (0.47) ACMSDPTGS2TDP1MEN1KMT2A
SCHEMBL6344544 0.93 ACMSD (0.49) ACMSDPTGS2TDP1MEN1KMT2A
SCHEMBL29094917 0.93 ACMSD (0.47) ACMSDPTGS2TDP1MEN1KMT2A

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-6900353-B2 Cyclopentyl sulfonamide derivatives ELI LILLY AND COMPANY (US) 2005-05-31 US disclosed
US-20040067984-A1 Cyclopentyl sulfonamide derivatives CANTRELL BUDDY EUGENE (US) 2004-04-08 US disclosed
EP-1334087-A1 CYCLOALKYLFLUOROSULFONAMIDE DERIVATIVES ELI LILLY AND COMPANY (US) 2003-08-13 EP disclosed
WO-2002032858-A1 CYCLOALKYLFLUOROSULFONAMIDE DERIVATIVES ELI LILLY AND COMPANY (US) 2002-04-25 WO 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-20040067984-A1 Cyclopentyl sulfonamide derivatives GRIN2A, GRIN1, GRIK5 ACMSD 2940/4885PTGS2 639/4885TDP1 2399/4885

“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.