SCHEMBL24486829

SCHEMBL24486829

CCN(CC)CCOCc1cc(=O)oc2ccccc12

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ XDH P47989 1/20 0.48
▸ POLB P06746 1/20 0.44
▸ CYP19A1 P11511 1/20 0.43
▸ ALK Q9UM73 1/20 0.43
▸ HSD17B3 P37058 3/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ NQO1 P15559 1/20 0.41
▸ CYP1A2 P05177 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ KCNA3 P22001 1/20 0.40
▸ TLR7 Q9NYK1 1/20 0.40

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
SCHEMBL21533705 0.84 CDYL (0.46) XDHPOLBTDP1KDM4EALDH1A1
SCHEMBL14735837 0.82 NQO1 (0.55) CYP19A1HSD17B3ALDH1A1NQO1CYP1A2
SCHEMBL24486825 0.81 CYP2D6 (0.58) XDHALKTDP1KDM4EALDH1A1
SCHEMBL4369173 0.79 TDP1 (0.54) XDHCYP19A1HSD17B3TDP1KDM4E
SCHEMBL21533706 0.78 MEN1 (0.45) XDHPOLBTDP1KDM4EALDH1A1
SCHEMBL21533749 0.77 MEN1 (0.42) XDHPOLBHSD17B3TDP1KDM4E
SCHEMBL21533707 0.77 CYP19A1 (0.43) XDHCYP19A1HSD17B3TDP1KDM4E
SCHEMBL21171898 0.77 NPC1 (0.48) XDHCYP19A1TDP1ALDH1A1NQO1
SCHEMBL10640150 0.76 HSD17B3 (0.68) POLBCYP19A1HSD17B3KDM4EALDH1A1
SCHEMBL8372531 0.75 HSD17B3 (0.62) POLBCYP19A1HSD17B3KDM4EALDH1A1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11352325-B2 Rapid fluorescence tagging of glycans and other biomolecules with enhanced MS signals WATERS TECHNOLOGIES CORPORATION (US) 2022-06-07 — — 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-11352325-B2 Rapid fluorescence tagging of glycans and other biomolecules with enhanced MS signals FUT5, FUT6, ST3GAL3 XDH 4462/4885POLB 4498/4885CYP19A1 4617/4885

“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.

Send feedback