SCHEMBL23452096

SCHEMBL23452096

CNc1cc(-c2ccc3c(c2)OCCO3)sc1C(=O)OC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC6 Q9UBN7 1/20 0.49
▸ KDM4E B2RXH2 10/20 0.47
▸ MAPT P10636 5/20 0.47
▸ ALDH1A1 P00352 3/20 0.47
▸ LMNA P02545 2/20 0.47
▸ TP53 P04637 2/20 0.46
▸ HTT P42858 1/20 0.46
▸ ATM Q13315 1/20 0.46
▸ HPGD P15428 2/20 0.45
▸ IKBKB O14920 2/20 0.45
▸ NPSR1 Q6W5P4 6/20 0.45
▸ MAPK1 P28482 2/20 0.45
▸ GFER P55789 1/20 0.45
▸ KMT2A Q03164 2/20 0.44
▸ MEN1 O00255 1/20 0.43
▸ POLB P06746 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ CRHBP P24387 2/20 0.43
▸ CRHR2 Q13324 2/20 0.43
▸ NPC1 O15118 1/20 0.42

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
SCHEMBL23452076 0.93 KDM4E (0.49) KDM4EMAPTALDH1A1LMNATP53
SCHEMBL23452054 0.77 KDM4E (0.61) KDM4EMAPTALDH1A1LMNATP53
SCHEMBL2157496 0.76 MAPT (0.76) KDM4EMAPTALDH1A1LMNATP53
SCHEMBL23452097 0.75 NPSR1 (0.56) KDM4EMAPTALDH1A1LMNATP53
SCHEMBL23452115 0.74 IKBKB (0.53) HDAC6KDM4EMAPTALDH1A1LMNA
SCHEMBL23452104 0.74 KDM4E (0.54) KDM4EMAPTALDH1A1LMNATP53
SCHEMBL23452022 0.74 IKBKB (0.63) HDAC6KDM4EMAPTALDH1A1LMNA
SCHEMBL613270 0.73 KDM4E (0.57) KDM4EMAPTALDH1A1LMNATP53
SCHEMBL14886743 0.73 GSK3A (0.58) KDM4EMAPTALDH1A1LMNATP53
SCHEMBL23452027 0.72 MAPT (0.62) KDM4EMAPTALDH1A1LMNATP53

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-11306103-B2 Thieno[3,2-b]pyridine-5(4H)-one derivative compound, preparation method thereof and use thereof KOREA INSTITUTE OF OCEAN SCIENCE & TECHNOLOGY 2022-04-19 — — US disclosed
US-11306103-B2 Thieno[3,2-b]pyridine-5(4H)-one derivative compound, preparation method thereof and use thereof KOREA INSTITUTE OF OCEAN SCIENCE & TECHNOLOGY 2022-04-19 — — US disclosed
US-20210171539-A1 NOVEL THIENO[3,2-B]PYRIDINE-5(4H)-ONE DERIVATIVE COMPOUND, PREPARATION METHOD THEREOF AND USE THEREOF KOREA INSTITUTE OF OCEAN SCIENCE & TECHNOLOGY (KR) 2021-06-10 — — US disclosed
US-20210171539-A1 NOVEL THIENO[3,2-B]PYRIDINE-5(4H)-ONE DERIVATIVE COMPOUND, PREPARATION METHOD THEREOF AND USE THEREOF KOREA INSTITUTE OF OCEAN SCIENCE & TECHNOLOGY (KR) 2021-06-10 — — 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 (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-20210171539-A1 NOVEL THIENO[3,2-B]PYRIDINE-5(4H)-ONE DERIVATIVE COMPOUND, PREPARATION METHOD THEREOF AND USE THEREOF BRD4, BRPF3, AFF4 HDAC6 506/4885KDM4E 125/4885MAPT 2916/4885
US-11306103-B2 Thieno[3,2-b]pyridine-5(4H)-one derivative compound, preparation method thereof and use thereof BRD4, BRPF3, AFF4 HDAC6 557/4885KDM4E 159/4885MAPT 2983/4885

“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.

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