SCHEMBL4465565

SCHEMBL4465565

CCOC(=O)c1cccc2c(O)cccc12

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDC25B P30305 6/20 0.69
▸ CA12 O43570 3/20 0.62
▸ CA1 P00915 3/20 0.62
▸ CA2 P00918 3/20 0.62
▸ CA7 P43166 3/20 0.62
▸ CA9 Q16790 3/20 0.62
▸ CA14 Q9ULX7 3/20 0.62
▸ TSHR P16473 1/20 0.61
▸ ALDH1A1 P00352 2/20 0.53
▸ HSD17B10 Q99714 1/20 0.53
▸ CLEC4M Q9H2X3 1/20 0.52
▸ CDC25A P30304 1/20 0.52
▸ CDC25C P30307 1/20 0.52
▸ CCR6 P51684 1/20 0.52
▸ MEN1 O00255 1/20 0.51
▸ ESR1 P03372 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ ESR2 Q92731 1/20 0.51
▸ MAOA P21397 1/20 0.51
▸ MAOB P27338 1/20 0.51

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
SCHEMBL9150759 0.91 TSHR (0.73) CDC25BCA12CA1CA2CA7
SCHEMBL23484418 0.90 TSHR (0.61) CDC25BCA12CA1CA2CA7
SCHEMBL11060407 0.87 ALDH1A1 (0.64) CDC25BCA12CA1CA2CA7
SCHEMBL7848703 0.84 TSHR (0.63) CDC25BCA12CA1CA2CA7
SCHEMBL22531831 0.84 TSHR (0.63) CDC25BCA12CA1CA2CA7
SCHEMBL10961102 0.84 TSHR (0.66) CDC25BTSHRALDH1A1HSD17B10ESR1
SCHEMBL29671336 0.83 TSHR (0.73) CDC25BCA12CA1CA2CA7
SCHEMBL2569253 0.83 TSHR (0.73) CDC25BCA12CA1CA2CA7
SCHEMBL1235309 0.82 CA12 (0.67) CDC25BCA12CA1CA2CA7
SCHEMBL340364 0.82 CA12 (0.67) CDC25BCA12CA1CA2CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4448869-A HYDROXY AND CARBOXY OR ACYL SUBSTITUTED BENZENE OR NAPHTHALENE FUJI PHOTO FILM CO., LTD. (JP) 1984-05-15 — — US claimed
US-7629366-B2 Aminoalcohol derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2009-12-08 — — US disclosed
CN-1802355-A Aminoalcohol derivatives FUJISAWA PHARMACEUTICAL CO (JP) 2006-07-12 — — CN disclosed
US-20060100252-A1 Aminoalcohol derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2006-05-11 — — US disclosed
US-7037938-B2 Aminoalcohol derivatives ASTELLAS PHARMA INC. (JP) 2006-05-02 — — US disclosed
EP-1546086-A2 AMINOALCOHOL DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-06-29 — — EP disclosed
WO-2004002939-A2 AMINOALCOHOL DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-01-08 — — WO disclosed
US-20040006143-A1 For therapy of urinary incontinence FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-01-08 — — US disclosed
US-4448869-A HYDROXY AND CARBOXY OR ACYL SUBSTITUTED BENZENE OR NAPHTHALENE FUJI PHOTO FILM CO., LTD. (JP) 1984-05-15 — — 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 (2 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-20060100252-A1 Aminoalcohol derivatives H1-0, CHRM2, CHRM1 CDC25B 3351/4885CA12 2602/4885CA1 2409/4885
US-20040006143-A1 For therapy of urinary incontinence H1-0, HRH2, H1-2 CDC25B 2961/4885CA12 1562/4885CA1 557/4885

“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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