SCHEMBL5248488

SCHEMBL5248488

CC1(C)C2CC3CC(C2)CC1(C(=O)O)C3

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.36
CYP2C9 P11712 1/20 0.36
HSD11B1 P28845 1/20 0.36
EPHX1 P07099 1/20 0.35
EPHX2 P34913 1/20 0.35
ALDH1A1 P00352 2/20 0.34
GAA P10253 1/20 0.34
APLNR P35414 1/20 0.33
MAPT P10636 1/20 0.33

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
Hydrochloric Acid SCHEMBL27525501 0.98 THRB (0.35) THRBCYP2C9HSD11B1EPHX1EPHX2
Bromide SCHEMBL27511892 0.98 THRB (0.35) THRBCYP2C9HSD11B1EPHX1EPHX2
SCHEMBL4711516 0.88 THRB (0.34) THRBCYP2C9HSD11B1EPHX1EPHX2
SCHEMBL31084441 0.83 MAPK1 (0.36) THRBCYP2C9HSD11B1EPHX1EPHX2
SCHEMBL6860976 0.83 GAA (0.38) THRBCYP2C9HSD11B1EPHX1EPHX2
SCHEMBL2849062 0.81 ALDH1A1 (0.39) THRBCYP2C9EPHX1EPHX2ALDH1A1
SCHEMBL6854374 0.81 EPHX1 (0.34) THRBCYP2C9HSD11B1EPHX1EPHX2
Hydrochloric Acid SCHEMBL11330577 0.80 THRB (0.40) THRBCYP2C9EPHX1ALDH1A1
SCHEMBL4582380 0.78 EPHX2 (0.40) THRBCYP2C9HSD11B1EPHX1EPHX2
SCHEMBL28699821 0.78 THRB (0.36) THRBCYP2C9HSD11B1EPHX1EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109641962-A anti-B7-H3 antibodies and antibody drug conjugates 艾伯维公司 2019-04-16 CN disclosed
CN-109562168-A anti-CD 98 antibodies and antibody drug conjugates 艾伯维公司 2019-04-02 CN disclosed
CN-109562190-A ANTI-EGFR ANTIBODY DRUG CONJUGATES 艾伯维公司 2019-04-02 CN disclosed
WO-2017201581-A1 NON-TOXIC IRON CHELATORS WITH NEUROPROTECTIVE POTENTIAL THE UNIVERSITY OF SYDNEY (AU) 2017-11-30 WO disclosed
US-20120318969-A1 METHOD FOR THE DIFFERENTIATION OF ALTERNATIVE SOURCES OF NAPHTHENIC ACIDS UNIVERSITY OF PLYMOUTH (GB) 2012-12-20 US disclosed
EP-1861384-A1 11-BETA-HYDROXYSTEROID DEHYDROGENASE INHIBITORS Sterix Limited (GB) 2007-12-05 EP disclosed
CN-1308338-C Phosphorus compound DAICEL CHEM (JP) 2007-04-04 CN disclosed
WO-2006100502-A1 11-BETA-HYDROXYSTEROID DEHYDROGENASE INHIBITORS STERIX LIMITED (GB) 2006-09-28 WO disclosed
CN-1224625-C Phosphorus-containing compound DAICEL CHEM (JP) 2005-10-26 CN disclosed
CN-1597686-A Phosphorus compound DAICEL CHEM (JP) 2005-03-23 CN disclosed
US-6794528-B2 HEAT RESISTANCE, FLAME RETARDERS, STABILIZERS; REACTING DIALCOHOL COMPOUND WITH A PHOSPHYL OXYCHLORIDE COMPOUND DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2004-09-21 US disclosed
US-20030109736-A1 Phosphorus compound DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2003-06-12 US disclosed
EP-1277758-A1 PHOSPHORUS COMPOUND Daicel Chemical Industries, Ltd. (JP) 2003-01-22 EP disclosed
CN-1383429-A Phosphorus-containing compound DAICEL CHEM (JP) 2002-12-04 CN 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-20030109736-A1 Phosphorus compound NR4A1, POLL, NR0B1 THRB 1241/4885CYP2C9 3141/4885HSD11B1 276/4885

“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.