SCHEMBL4879932

SCHEMBL4879932

COC(=O)C1(c2cccc(OC)c2)CCC(=Cc2ccccc2)CC1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.44
ADAM17 P78536 2/20 0.44
ALDH1A1 P00352 3/20 0.42
MMP1 P03956 1/20 0.41
MMP2 P08253 1/20 0.41
MMP9 P14780 1/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
BCHE P06276 1/20 0.41
MAOB P27338 1/20 0.41
OPRM1 P35372 1/20 0.40
OPRD1 P41143 1/20 0.40
OPRK1 P41145 1/20 0.40
OPRL1 P41146 1/20 0.40
PIM1 P11309 1/20 0.39
AKR1B1 P15121 1/20 0.39
PIM2 Q9P1W9 1/20 0.39
GRIN2B Q13224 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
SCHEMBL4880129 0.87 SIGMAR1 (0.41) SIGMAR1ALDH1A1MEN1KMT2ABCHE
SCHEMBL4880120 0.85 KMT2A (0.41) SIGMAR1ALDH1A1MMP1MMP2MMP9
SCHEMBL27736564 0.82 ADAM17 (0.56) ADAM17ALDH1A1MEN1KMT2AOPRM1
SCHEMBL4876849 0.81 ADAM17 (0.50) SIGMAR1ADAM17ALDH1A1MEN1KMT2A
SCHEMBL30683829 0.80 ADAM17 (0.53) ADAM17ALDH1A1MEN1KMT2AOPRM1
SCHEMBL2846322 0.80 ADAM17 (0.53) ADAM17ALDH1A1MEN1KMT2AOPRM1
SCHEMBL8585754 0.79 ADAM17 (0.52) ADAM17ALDH1A1MEN1KMT2A
SCHEMBL4876722 0.77 SOAT1 (0.56) ADAM17ALDH1A1MEN1KMT2AOPRM1
SCHEMBL5470501 0.76 OPRM1 (0.50) ADAM17ALDH1A1MEN1KMT2AOPRM1
SCHEMBL4868377 0.76 ADAM17 (0.48) SIGMAR1ADAM17ALDH1A1MEN1KMT2A

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-20080096922-A1 Novel Sulfonamide derivative DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2008-04-24 US disclosed
EP-1736467-A1 NOVEL SULFONAMIDE DERIVATIVE Dainippon Sumitomo Pharma Co., Ltd. (JP) 2006-12-27 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-20080096922-A1 Novel Sulfonamide derivative NR4A1, NR4A2, NR4A3 SIGMAR1 298/4885ADAM17 4084/4885ALDH1A1 2899/4885

“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.