SCHEMBL504018

SCHEMBL504018

CC(C)(O)C(C)(C)O.CC(C)(O)C(C)(C)O

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.55
ALDH1A1 P00352 4/20 0.42
TSHR P16473 2/20 0.39
LMNA P02545 1/20 0.33
CYP2C19 P33261 1/20 0.31

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
SCHEMBL27028519 1.00 THRB (0.55) THRBALDH1A1TSHRLMNACYP2C19
SCHEMBL8968 1.00
Hydrochloric Acid SCHEMBL7537660 0.94
Water SCHEMBL11045586 0.94
SCHEMBL1163579 0.94 THRB (0.50) THRBALDH1A1TSHRLMNA
Water SCHEMBL3827178 0.94 THRB (0.50) THRBALDH1A1TSHRLMNA
SCHEMBL129302 0.94
SCHEMBL402114 0.94 THRB (0.50) THRBALDH1A1TSHRLMNA
SCHEMBL21494164 0.94 THRB (0.50) THRBALDH1A1TSHRLMNA
Ammonia Solution, Strong SCHEMBL8694521 0.94

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8940283-B2 Cosmetic composition comprising at least one cationic poly(vinyllactam), at least one fatty alcohol, and at least one polyol, cosmetic process for treating keratin fibers and use of the composition L'OREAL (FR) 2015-01-27 US claimed
US-20060128575-A1 Traction fluid composition GEIGER RENE 2006-06-15 US claimed
EP-3790867-B1 KDM1A INHIBITORS FOR THE TREATMENT OF DISEASE IMAGO BIOSCIENCES INC (US) 2024-03-27 EP disclosed
US-11932629-B2 KDM1A inhibitors for the treatment of disease IMAGO BIOSCIENCES, INC. (US) 2024-03-19 US disclosed
CN-112513020-B KDM1A inhibitors for the treatment of diseases 伊美格生物科学公司 2024-02-23 CN disclosed
CN-117466884-A Heterocyclic compounds or salts thereof as ATR kinase inhibitors, pharmaceutical compositions containing same and uses thereof 德州大学系统董事会 2024-01-30 CN disclosed
CN-112218631-B Heterocyclic inhibitors of ATR kinase 德州大学系统董事会 2023-12-22 CN disclosed
EP-3651768-B1 HETEROCYCLIC INHIBITORS OF ATR KINASE UNIV TEXAS (US) 2023-12-20 EP disclosed
CN-111867590-B Heterocyclic inhibitors of ATR kinase 德州大学系统董事会 2023-11-17 CN disclosed
EP-3947384-B1 ISOCHROMENE DERIVATIVES AS PHOSPHOINOSITIDE 3-KINASES INHIBITORS CHIESI FARM SPA (IT) 2023-11-01 EP disclosed
US-20230250090-A1 KDM1A INHIBITORS FOR THE TREATMENT OF DISEASE IMAGO BIOSCIENCES INC (US) 2023-08-10 US disclosed
US-20040138175-A1 Boronic acid salts useful in parenteral formulations TRIGEN LIMITED 2004-07-15 US disclosed
EP-1400245-A1 Boronic acid salts useful in parenteral formulations for selective thrombin inhibition TRIGEN LIMITED (GB) 2004-03-24 EP disclosed
WO-2004022072-A1 BORONIC ACID SALTS ANT THEIR USE IN THE TREATMENT OF THROMBOSIS TRIGEN LIMITED (GB) 2004-03-18 WO disclosed
WO-2004022071-A1 MULTIVALENT METAL SALTS OF BORONIC ACIDS FOR TREATING THROMBOSIS TRIGEN LIMITED (GB) 2004-03-18 WO disclosed
EP-1396270-A1 Boronic acid salts and use thereof in the preparation of medicaments for treating thrombosis TRIGEN LIMITED (GB) 2004-03-10 EP disclosed
EP-1396269-A1 Boronic acid salts of multivalent metals used in the preparation of a medicament for treating thrombosis TRIGEN LIMITED (GB) 2004-03-10 EP disclosed
US-6329489-B1 CONTACTING UNSYMMETRICAL DIFUNCTIONAL SILANE MONOMERS WITH WATER, WITH DIOL MONOMERS TO PRODUCE REACTIVE SILANE OLIGOMER E. I. DU PONT DE NEMOURS AND COMPANY 2001-12-11 US disclosed
CN-1243551-A Electrochemical cell and electrochemical system ELECTROLYSER CORP LTD (CA) 2000-02-02 CN disclosed
US-3984294-A ELECTROLYTIC HYDRODIMERIZATION OF ACETONE BASF AKTIENGESELLSCHAFT (DT) 1976-10-05 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 (3 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-11932629-B2 KDM1A inhibitors for the treatment of disease KDM1B, KDM1A, KDM2A THRB 3400/4885ALDH1A1 839/4885TSHR 4447/4885
US-20230250090-A1 KDM1A INHIBITORS FOR THE TREATMENT OF DISEASE KDM1B, KDM1A, KDM2A THRB 3400/4885ALDH1A1 839/4885TSHR 4447/4885
US-20040138175-A1 Boronic acid salts useful in parenteral formulations HBZ, BPGM, GCG THRB 190/4885ALDH1A1 4879/4885TSHR 673/4885

“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.