SCHEMBL7674336

SCHEMBL7674336

COc1cccc(S(=O)(=O)C2CNCCO2)c1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 7/20 0.47
SLC6A2 P23975 2/20 0.42
SLC6A4 P31645 2/20 0.42
PKM P14618 1/20 0.41
PKLR P30613 1/20 0.41
HTR2C P28335 3/20 0.40
CYP3A4 P08684 1/20 0.40
EED O75530 1/20 0.39
PGR P06401 1/20 0.39
SLC6A3 Q01959 1/20 0.39
FFAR4 Q5NUL3 1/20 0.39
KEAP1 Q14145 1/20 0.39
NFE2L2 Q16236 1/20 0.39

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
SCHEMBL28153720 0.83 LMNA (0.44) PKMPKLR
SCHEMBL7671592 0.80 DRD2 (0.52) HTR6SLC6A2SLC6A4PKM
SCHEMBL6422590 0.79 SLC6A2 (0.38) HTR6SLC6A2SLC6A4SLC6A3
SCHEMBL28285086 0.78 LMNA (0.42)
SCHEMBL28091851 0.77 AKR1C3 (0.47)
SCHEMBL4636714 0.77 HTR6 (0.37) HTR6SLC6A2SLC6A4SLC6A3
SCHEMBL16818398 0.74 HTR2C (0.54) HTR6HTR2CCYP3A4PGRFFAR4
SCHEMBL6128169 0.74 KMT2A (0.36) SLC6A2SLC6A4HTR2CSLC6A3
SCHEMBL28433779 0.74 HTR6 (0.39) HTR6
SCHEMBL28092048 0.73 PKM (0.41) PKM

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-20020037888-A1 4-imidazol-1-ylmethyl-2-(2-(2-oxo-piperidin-1-yl)-phenoxy) -benzonitrile for example; farnesyl-protein transferase inhibitors; treating cancer, benign proliferative disorder, hepatitis virus, restenosis, and polycystic kidney disease MERCK & CO., INC. 2002-03-28 US disclosed
US-6284755-B1 Inhibitors of prenyl-protein transferase MERCK & CO., INC. 2001-09-04 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-20020037888-A1 4-imidazol-1-ylmethyl-2-(2-(2-oxo-piperidin-1-yl)-phenoxy) -benzonitrile for example; farnesyl-protein transferase inhibitors; treating cancer, benign proliferative disorder, hepatitis virus, restenosis, and polycystic kidney disease FNTA, PKD1, FNTB HTR6 4808/4885SLC6A2 4798/4885SLC6A4 4401/4885

“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.