SCHEMBL22358672

SCHEMBL22358672

CCCC(C)c1ccccc1C(=O)OC

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.47
TSHR P16473 1/20 0.47
ALDH1A1 P00352 6/20 0.46
HSD17B10 Q99714 2/20 0.46
CFTR P13569 1/20 0.46
KMT2A Q03164 3/20 0.45
KDM4E B2RXH2 5/20 0.45
POLB P06746 3/20 0.45
ATM Q13315 2/20 0.45
GAA P10253 3/20 0.44
CYP1A2 P05177 1/20 0.43
CYP2C19 P33261 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
GLA P06280 1/20 0.43
ALOX12 P18054 1/20 0.42
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA5A P35218 1/20 0.41
CA9 Q16790 1/20 0.41

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
SCHEMBL29139944 0.89 ALDH1A1 (0.50) LMNATSHRALDH1A1HSD17B10CFTR
SCHEMBL1786603 0.87 TSHR (0.52) LMNATSHRALDH1A1HSD17B10CFTR
SCHEMBL3417958 0.83 TSHR (0.50) LMNATSHRALDH1A1HSD17B10CFTR
SCHEMBL21436062 0.83 ALDH1A1 (0.49) LMNATSHRALDH1A1HSD17B10CFTR
SCHEMBL24810412 0.82 TSHR (0.49) LMNATSHRALDH1A1HSD17B10CFTR
SCHEMBL6859419 0.81 KMT2A (0.47) TSHRALDH1A1HSD17B10KMT2AKDM4E
SCHEMBL254882 0.81 TSHR (0.59) LMNATSHRALDH1A1HSD17B10CFTR
SCHEMBL7639705 0.80 LMNA (0.44) LMNATSHRALDH1A1HSD17B10CFTR
SCHEMBL30768207 0.80 CYP1A2 (0.47) LMNATSHRALDH1A1HSD17B10CFTR
SCHEMBL8095263 0.80 POLB (0.44) TSHRALDH1A1KMT2AKDM4EPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11578071-B2 Preparation of pyrazolo[3,4-B]pyridines as antimalarials UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION (US) 2023-02-14 US disclosed
US-20210101901-A1 PREPARATION OF PYRAZOLO[3,4-B]PYRIDINES AS ANTIMALARIALS CAL POLY CORPORATION 2021-04-08 US disclosed
US-10961211-B2 Isotopically-stabilized tetronimide compounds MIDWESTERN UNIVERSITY (US) 2021-03-30 US disclosed
US-20200262804-A1 Isotopically-Stabilized Tetronimide Compounds MIDWESTERN UNIVERSITY 2020-08-20 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 (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-10961211-B2 Isotopically-stabilized tetronimide compounds ASPH, BACE1, DNPEP LMNA 2143/4885TSHR 846/4885ALDH1A1 2566/4885
US-20200262804-A1 Isotopically-Stabilized Tetronimide Compounds ASPH, BACE1, DNPEP LMNA 2143/4885TSHR 846/4885ALDH1A1 2566/4885
US-20210101901-A1 PREPARATION OF PYRAZOLO[3,4-B]PYRIDINES AS ANTIMALARIALS PNPO, NOX3, G6PD LMNA 2879/4885TSHR 3974/4885ALDH1A1 2771/4885
US-11578071-B2 Preparation of pyrazolo[3,4-B]pyridines as antimalarials PNPO, NOX3, G6PD LMNA 2879/4885TSHR 3974/4885ALDH1A1 2771/4885

“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.