SCHEMBL1036200

SCHEMBL1036200

O=C([O-])C(O)CO.O=C([O-])C(O)CO.O=C([O-])C(O)CO.[Al+3]

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA4 P22748 3/20 0.52
OR51E2 Q9H255 1/20 0.50
LMNA P02545 2/20 0.42
CYP3A4 P08684 2/20 0.32
TSHR P16473 2/20 0.32
NFKB1 P19838 2/20 0.32
NPSR1 Q6W5P4 2/20 0.32
ALDH1A1 P00352 1/20 0.32
CTSL P07711 1/20 0.31
TP53 P04637 1/20 0.30
AKR1B1 P15121 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL11768943 0.97 CA4 (0.55) CA4OR51E2LMNACYP3A4TSHR
Silver SCHEMBL9803480 0.94
SCHEMBL10789752 0.94 CA4 (0.52) CA4OR51E2LMNACYP3A4TSHR
SCHEMBL2512864 0.94 CA4 (0.52) CA4OR51E2LMNACYP3A4TSHR
SCHEMBL320248 0.94
SCHEMBL9651902 0.94 CA4 (0.52) CA4OR51E2LMNACYP3A4TSHR
SCHEMBL3154885 0.94 CA4 (0.52) CA4OR51E2LMNACYP3A4TSHR
SCHEMBL8953691 0.94 CA4 (0.52) CA4OR51E2LMNACYP3A4TSHR
SCHEMBL291843 0.94 CA4 (0.52) CA4OR51E2LMNACYP3A4TSHR
SCHEMBL9251243 0.94 CA4 (0.57) CA4OR51E2LMNACYP3A4TSHR

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 173 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115531355-A Tranexamic acid gel plaster and preparation method thereof 湖南科锐斯医药科技有限公司 2022-12-30 CN claimed
CN-110917290-A Medicine for treating hyperplasia of mammary glands and preparation method thereof 贵州康琦药械有限公司 2020-03-27 CN claimed
EP-3218956-B1 FAST CHARGE APPARATUS FOR A BATTERY INTEC ENERGY STORAGE CORP (CA) 2019-08-07 EP claimed
EP-3218953-B1 SECONDARY BATTERY WITH NON-AQUEOUS ELECTROLYTE INTEC ENERGY STORAGE CORP (CA) 2019-08-07 EP claimed
US-10084206-B2 Fast charge apparatus for a battery INTEC ENERGY STORAGE CORP. (CA) 2018-09-25 US claimed
US-9912008-B2 Electrical energy storage device with non-aqueous electrolyte INTEC ENERGY STORAGE CORPORATION (CA) 2018-03-06 US claimed
EP-3218953-A1 ELECTRICAL ENERGY STORAGE DEVICE WITH NON-AQUEOUS ELECTROLYTE Intec Energy Storage Corp. (CA) 2017-09-20 EP claimed
EP-3218956-A1 FAST CHARGE APPARATUS FOR A BATTERY Intec Energy Storage Corp. (CA) 2017-09-20 EP claimed
US-20150147661-A1 FAST CHARGE APPARATUS FOR A BATTERY INTEC ENERGY STORAGE CORP. (CA) 2015-05-28 US claimed
US-20150147663-A1 ELECTRICAL ENERGY STORAGE DEVICE WITH NON-AQUEOUS ELECTROLYTE INTEC ENERGY STORAGE CORPORATION (CA) 2015-05-28 US claimed
US-20040136941-A1 Cosmetic and dermatological preparation for removing sebum or regulating sebum production BEIERSDORF AG 2004-07-15 US claimed
EP-1392398-A2 COSMETIC AND DERMATOLOGICAL PREPARATIONS FOR REMOVING AND REGULATING SEBUM Beiersdorf AG (DE) 2004-03-03 EP claimed
WO-2002092029-A2 COSMETIC AND DERMATOLOGICAL PREPARATIONS FOR REMOVING AND REGULATING SEBUM BEIERSDORF AG (DE) 2002-11-21 WO claimed
EP-1172084-A2 Cosmetic and dermatologic composition to eliminate sebum Beiersdorf Aktiengesellschaft (DE) 2002-01-16 EP claimed
EP-0521317-B1 Bathing preparation containing soluble aluminium carboxylate KAO CORP (JP) 1997-04-09 EP claimed
US-5389678-A Refreshing sensation to users KAO CORPORATION (JP) 1995-02-14 US claimed
US-5310758-A Water soluble aluminum carboxylate; dissolvability; feel, freshness KAO CORPORATION (JP) 1994-05-10 US claimed
EP-0521317-A2 Bathing preparation containing soluble aluminium carboxylate Kao Corporation (JP) 1993-01-07 EP claimed
CN-115531355-A Tranexamic acid gel plaster and preparation method thereof 湖南科锐斯医药科技有限公司 2022-12-30 CN disclosed
EP-0521317-A2 Bathing preparation containing soluble aluminium carboxylate Kao Corporation (JP) 1993-01-07 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-20040136941-A1 Cosmetic and dermatological preparation for removing sebum or regulating sebum production CUTA, TYR, HDAC5 CA4 312/4885OR51E2 839/4885LMNA 4267/4885

“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.