SCHEMBL4868377

SCHEMBL4868377

COC(=O)C1(c2cccc(OC)c2)CCC(c2ccccc2)CC1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ADAM17 P78536 2/20 0.48
▸ SIGMAR1 Q99720 3/20 0.46
▸ ALDH1A1 P00352 3/20 0.45
▸ KDM4E B2RXH2 1/20 0.44
▸ LMNA P02545 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ GRIN2B Q13224 2/20 0.44
▸ HTR2C P28335 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ OPRD1 P41143 1/20 0.42
▸ CRHBP P24387 1/20 0.42
▸ CRHR2 Q13324 1/20 0.42

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
SCHEMBL4880013 0.90 ALDH1A1 (0.46) SIGMAR1ALDH1A1KDM4ELMNATSHR
SCHEMBL4877607 0.87 SIGMAR1 (0.42) ADAM17SIGMAR1ALDH1A1KDM4ELMNA
SCHEMBL4882566 0.85 HDAC4 (0.48) ADAM17ALDH1A1GRIN2BMEN1KMT2A
SCHEMBL4872683 0.85 ADAM17 (0.52) ADAM17ALDH1A1MEN1KMT2ACRHBP
SCHEMBL4877598 0.84 OPRD1 (0.41) ADAM17ALDH1A1KDM4ELMNATSHR
SCHEMBL27736564 0.84 ADAM17 (0.56) ADAM17ALDH1A1MEN1KMT2AOPRD1
SCHEMBL2846322 0.82 ADAM17 (0.53) ADAM17ALDH1A1TSHRMEN1KMT2A
SCHEMBL30683829 0.82 ADAM17 (0.53) ADAM17ALDH1A1TSHRMEN1KMT2A
SCHEMBL5465979 0.81 ALDH1A1 (0.53) ADAM17SIGMAR1ALDH1A1MEN1KMT2A
SCHEMBL5465983 0.81 ALDH1A1 (0.53) ADAM17SIGMAR1ALDH1A1MEN1KMT2A

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 ADAM17 4084/4885SIGMAR1 298/4885ALDH1A1 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.

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