SCHEMBL8664189

SCHEMBL8664189

CC(C)(C)c1cc(Br)cc(C(C)(C)C)c1[O-].CC(C)(C)c1cc(Br)cc(C(C)(C)C)c1[O-].C[Al+2]

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.33
ALOX15 P16050 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
KDM4E B2RXH2 1/20 0.33
CYP1A2 P05177 1/20 0.33
MAPT P10636 1/20 0.33
ATP2A2 P16615 1/20 0.33
ATP2A3 Q93084 1/20 0.33
PTGDR2 Q9Y5Y4 1/20 0.33
TYR P14679 2/20 0.32
NR1I2 O75469 1/20 0.32
LMNA P02545 1/20 0.32
CYP2C9 P11712 1/20 0.32
MIF P14174 1/20 0.32
HTT P42858 1/20 0.32
NFE2L2 Q16236 1/20 0.32
HSD17B10 Q99714 1/20 0.32
CA2 P00918 3/20 0.31
CA1 P00915 1/20 0.31
POLB P06746 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
SCHEMBL6352500 0.78 GABRA1 (0.39) ALDH1A1ALOX15SMN1; SMN2KDM4ECYP1A2
Butylated Hydroxytoluene SCHEMBL496998 0.78 ALDH1A1 (0.52) ALDH1A1ALOX15SMN1; SMN2KDM4ECYP1A2
SCHEMBL4572705 0.74 ALDH1A1 (0.39) ALDH1A1ALOX15SMN1; SMN2KDM4ECYP1A2
SCHEMBL6349436 0.73 HSPA5 (0.48) ALDH1A1ALOX15SMN1; SMN2KDM4ECYP1A2
SCHEMBL2787305 0.72 ALDH1A1 (0.38) ALDH1A1ALOX15SMN1; SMN2KDM4ECYP1A2
SCHEMBL10660854 0.72 PTGDR2 (0.39) ALDH1A1ALOX15SMN1; SMN2KDM4ECYP1A2
SCHEMBL19614553 0.72 SMN1; SMN2 (0.39) ALDH1A1ALOX15SMN1; SMN2KDM4ECYP1A2
Butylated Hydroxytoluene SCHEMBL23090058 0.70 SMN1; SMN2 (0.54) ALDH1A1ALOX15SMN1; SMN2KDM4ECYP1A2
Butylated Hydroxytoluene SCHEMBL20455508 0.70 SMN1; SMN2 (0.54) ALDH1A1ALOX15SMN1; SMN2KDM4ECYP1A2
Butylated Hydroxytoluene SCHEMBL4820691 0.70 SMN1; SMN2 (0.54) ALDH1A1ALOX15SMN1; SMN2KDM4ECYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230088507-A1 TRIAZINE UV ABSORBERS AND A PROCESS FOR THE PREPARATION THEREOF BASF SE (DE) 2023-03-23 US claimed
US-20220119357-A1 A PROCESS FOR THE PREPARATION OF TRIAZINE INTERMEDIATES AND A PROCESS FOR THE PREPARATION OF UV ABSORBERS THEREOF BASF SE (DE) 2022-04-21 US claimed
EP-3908576-A1 A PROCESS FOR THE PREPARATION OF UV ABSORBERS BASF SE (DE) 2021-11-17 EP claimed
EP-3908633-A1 A PROCESS FOR THE PREPARATION OF TRIAZINE INTERMEDIATES AND A PROCESS FOR THE PREPARATION OF UV ABSORBERS THEREOF BASF SE (DE) 2021-11-17 EP claimed
WO-2021130380-A1 TRIAZINE UV ABSORBERS AND A PROCESS FOR THE PREPARATION THEREOF BASF SE (DE) 2021-07-01 WO claimed
US-20210139442-A1 D-GLUCARO-6,3-LACTONE MONOESTER AND A PROCESS FOR THE PREPARATION THEREOF BASF SE (DE) 2021-05-13 US claimed
EP-3781551-A1 D-GLUCARO-6,3-LACTONE MONOESTER AND A PROCESS FOR THE PREPARATION THEREOF BASF SE (DE) 2021-02-24 EP claimed
CN-112041309-A D-glucaric acid-6, 3-lactone monoester and preparation method thereof 巴斯夫欧洲公司 2020-12-04 CN claimed
WO-2020144093-A1 A PROCESS FOR THE PREPARATION OF TRIAZINE INTERMEDIATES AND A PROCESS FOR THE PREPARATION OF UV ABSORBERS THEREOF BASF SE (DE) 2020-07-16 WO claimed
WO-2020144094-A1 A PROCESS FOR THE PREPARATION OF UV ABSORBERS BASF SE (DE) 2020-07-16 WO claimed
WO-2019201718-A1 D-GLUCARO-6,3-LACTONE MONOESTER AND A PROCESS FOR THE PREPARATION THEREOF BASF SE (DE) 2019-10-24 WO claimed
US-9475743-B2 Process for the preparation of substituted TRIS(2-hydroxyphenyl)methane Wintershall Holding GmbH (DE) 2016-10-25 US claimed
US-20160016871-A1 Process For The Preparation Of Substituted TRIS(2-Hydroxyphenyl)Methane Wintershall Holding GmbH (DE) 2016-01-21 US claimed
EP-2970069-A1 PROCESS FOR THE PREPARATION OF SUBSTITUTED TRIS(2-HYDROXYPHENYL)METHANE Wintershall Holding GmbH (DE) 2016-01-20 EP claimed
WO-2014139808-A1 PROCESS FOR THE PREPARATION OF SUBSTITUTED TRIS(2-HYDROXYPHENYL)METHANE Wintershall Holding GmbH (DE) 2014-09-18 WO claimed
JP-10077248-A None JP disclosed
EP-4357353-A1 PEPTIDE COMPOUND PRODUCTION METHOD Chubu University Educational Foundation (JP) 2024-04-24 EP disclosed
EP-2970069-A1 PROCESS FOR THE PREPARATION OF SUBSTITUTED TRIS(2-HYDROXYPHENYL)METHANE Wintershall Holding GmbH (DE) 2016-01-20 EP disclosed
WO-2014139808-A1 PROCESS FOR THE PREPARATION OF SUBSTITUTED TRIS(2-HYDROXYPHENYL)METHANE Wintershall Holding GmbH (DE) 2014-09-18 WO disclosed
JP-H1077248-A PRODUCTION OF ACYLOXYKETONE DAISO CO LTD 1998-03-24 JP 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 (4 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-20210139442-A1 D-GLUCARO-6,3-LACTONE MONOESTER AND A PROCESS FOR THE PREPARATION THEREOF GALE, MGAM, UGGT1 ALDH1A1 1457/4885ALOX15 660/4885SMN1; SMN2 4726/4885
US-20220119357-A1 A PROCESS FOR THE PREPARATION OF TRIAZINE INTERMEDIATES AND A PROCESS FOR THE PREPARATION OF UV ABSORBERS THEREOF DHPS, NISCH, UNG ALDH1A1 529/4885ALOX15 1466/4885SMN1; SMN2 4823/4885
US-20160016871-A1 Process For The Preparation Of Substituted TRIS(2-Hydroxyphenyl)Methane HPD, SQLE, CYP4A11 ALDH1A1 4666/4885ALOX15 693/4885SMN1; SMN2 4282/4885
US-20230088507-A1 TRIAZINE UV ABSORBERS AND A PROCESS FOR THE PREPARATION THEREOF NISCH, DHPS, UMPS ALDH1A1 1053/4885ALOX15 1350/4885SMN1; SMN2 4768/4885

“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.