SCHEMBL2856954

SCHEMBL2856954

COC(=O)CC(O)(CC(=O)O)C(=O)O.[NaH]

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.62
HMGCR P04035 1/20 0.39
CHRM1 P11229 1/20 0.39
TBXA2R P21731 1/20 0.39
ADRA1A P35348 1/20 0.39
TSHR P16473 5/20 0.39
KDM4E B2RXH2 2/20 0.38
LMNA P02545 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
HSD17B10 Q99714 2/20 0.38
MAPT P10636 1/20 0.38
ALOX15 P16050 1/20 0.38
HPGD P15428 1/20 0.38
RECQL P46063 1/20 0.38
CYP2D6 P10635 2/20 0.38
CYP2C19 P33261 1/20 0.38
HIF1A Q16665 1/20 0.38
SLC13A5 Q86YT5 9/20 0.38
CYP1A2 P05177 1/20 0.36

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
SCHEMBL27800877 1.00 ALDH1A1 (0.62) ALDH1A1HMGCRCHRM1TBXA2RADRA1A
Water SCHEMBL23500859 0.98 ALDH1A1 (0.60) ALDH1A1HMGCRCHRM1TBXA2RADRA1A
SCHEMBL454845 0.98 ALDH1A1 (0.65) ALDH1A1HMGCRCHRM1TBXA2RADRA1A
Phosphine SCHEMBL3270330 0.96 ALDH1A1 (0.62) ALDH1A1HMGCRCHRM1TBXA2RADRA1A
Ammonia Solution, Strong SCHEMBL28707739 0.96 ALDH1A1 (0.62) ALDH1A1HMGCRCHRM1TBXA2RADRA1A
Water SCHEMBL27925641 0.96 ALDH1A1 (0.62) ALDH1A1HMGCRCHRM1TBXA2RADRA1A
SCHEMBL28171905 0.92 ALDH1A1 (0.58) ALDH1A1HMGCRCHRM1TBXA2RADRA1A
SCHEMBL23331 0.91 ALDH1A1 (0.52) ALDH1A1HMGCRCHRM1TBXA2RADRA1A
Citric Acid SCHEMBL14860953 0.90 ALDH1A1 (0.56) ALDH1A1HMGCRCHRM1TBXA2RADRA1A
Ammonia Solution, Strong SCHEMBL28693679 0.89 ALDH1A1 (0.50) ALDH1A1HMGCRCHRM1TBXA2RADRA1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118329988-A Coloring method of electrochemical biosensor enzyme solution 浙江世佳生物医疗有限公司 2024-07-12 CN claimed
CN-118329988-A Coloring method of electrochemical biosensor enzyme solution 浙江世佳生物医疗有限公司 2024-07-12 CN disclosed
CN-114807289-A Novel metabolic marker for preparing medicine for treating liver cancer and application thereof 武汉大学 2022-07-29 CN disclosed
EP-3096710-A1 DENTAL TREATMENT CAPSULE, FORMULATION AND DEVICE Smartjet Technologies Ltd. (IL) 2016-11-30 EP disclosed
WO-2015111051-A1 DENTAL TREATMENT CAPSULE, FORMULATION AND DEVICE SMARTJET TECHNOLOGIES LTD (IL) 2015-07-30 WO disclosed
WO-2015037006-A1 APPARATUS AND METHOD FOR HAIR REMOVAL AND SKIN EXFOLIATION GREENBERG ILAN (IL) 2015-03-19 WO disclosed
US-7858661-B2 Protein refolding agent and refolding method SANYO CHEMICAL INDUSTRIES, LTD. (JP) 2010-12-28 US disclosed
US-20100168403-A1 Protein refolding agent and refolding method YAMAGUCHI SHUNICHLRO 2010-07-01 US disclosed
US-20090111971-A1 PROTEIN REFOLDING AGENT AND REFOLDING METHOD SANYO CHEMICAL INDUSTRIES, LTD. (JP) 2009-04-30 US disclosed
EP-1088052-A1 USE OF CARBON DIOXIDE AND CARBONIC ACID TO CLEAN CONTACT LENSES Alcon Laboratories, Inc. (US) 2001-04-04 EP disclosed
WO-1999066020-A1 USE OF CARBON DIOXIDE AND CARBONIC ACID TO CLEAN CONTACT LENSES ALCON LABORATORIES, INC. (US) 1999-12-23 WO 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-20090111971-A1 PROTEIN REFOLDING AGENT AND REFOLDING METHOD HSPA5, HSPBP1, RRBP1 ALDH1A1 2346/4885HMGCR 1276/4885CHRM1 4822/4885
US-20100168403-A1 Protein refolding agent and refolding method HSPA5, HSPBP1, RRBP1 ALDH1A1 2627/4885HMGCR 1158/4885CHRM1 4817/4885

“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.