SCHEMBL16620770

SCHEMBL16620770

C=CCc1cccc2ncc(C(=O)OCC)cc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.48
KDM4E B2RXH2 4/20 0.47
HSD17B10 Q99714 2/20 0.47
MAPT P10636 4/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
LMNA P02545 1/20 0.45
POLB P06746 1/20 0.45
RXFP1 Q9HBX9 1/20 0.44
TP53 P04637 1/20 0.44
RAB9A P51151 4/20 0.43
NPC1 O15118 3/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
ABCB1 P08183 1/20 0.43
HTT P42858 1/20 0.43
ABCG2 Q9UNQ0 1/20 0.43
CREBBP Q92793 1/20 0.42
MAPK1 P28482 1/20 0.42
HPGD P15428 2/20 0.42
PKM P14618 2/20 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
SCHEMBL16620896 0.89 MAPT (0.46) ALDH1A1KDM4EHSD17B10MAPTSMN1; SMN2
SCHEMBL18109913 0.82 MGAM (0.48) ALDH1A1KDM4EHSD17B10MAPTSMN1; SMN2
SCHEMBL16620773 0.81 MAPT (0.44) ALDH1A1KDM4EHSD17B10MAPTSMN1; SMN2
SCHEMBL10465583 0.80 ALDH1A1 (0.52) ALDH1A1KDM4EHSD17B10MAPTSMN1; SMN2
SCHEMBL2199853 0.80 CA12 (0.51) ALDH1A1KDM4EHSD17B10MAPTSMN1; SMN2
SCHEMBL16620956 0.79 CYP1A2 (0.43) ALDH1A1KDM4EHSD17B10MAPTSMN1; SMN2
SCHEMBL2202907 0.79 MAOB (0.50) ALDH1A1KDM4EHSD17B10MAPTSMN1; SMN2
SCHEMBL9103181 0.79 MAPT (0.50) ALDH1A1KDM4EHSD17B10MAPTSMN1; SMN2
SCHEMBL2199970 0.78 PDGFRB (0.52) ALDH1A1KDM4EMAPTSMN1; SMN2LMNA
SCHEMBL16621085 0.77 MEN1 (0.46) ALDH1A1KDM4EHSD17B10MAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240254110-A1 FUSED 1,4-DIHYDRODIOXIN DERIVATIVES AS INHIBITORS OF HEAT SHOCK TRANSCRIPTION FACTOR 1 CANCER RESEARCH TECH LTD (GB) 2024-08-01 US disclosed
US-11787786-B2 Fused 1,4-dihydrodioxin derivatives as inhibitors of heat shock transcription factor 1 CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2023-10-17 US disclosed
US-20220220097-A1 FUSED 1,4-DIHYDRODIOXIN DERIVATIVES AS INHIBITORS OF HEAT SHOCK TRANSCRIPTION FACTOR 1 CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2022-07-14 US disclosed
EP-3052492-A1 FUSED 1,4-DIHYDRODIOXIN DERIVATIVES AS INHIBITORS OF HEAT SHOCK TRANSCRIPTION FACTOR 1 Cancer Research Technology Limited (GB) 2016-08-10 EP disclosed
WO-2015049535-A1 FUSED 1,4-DIHYDRODIOXIN DERIVATIVES AS INHIBITORS OF HEAT SHOCK TRANSCRIPTION FACTOR 1 CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2015-04-09 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 (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-20240254110-A1 FUSED 1,4-DIHYDRODIOXIN DERIVATIVES AS INHIBITORS OF HEAT SHOCK TRANSCRIPTION FACTOR 1 HSF1, HSP90AB1, HSPB1 ALDH1A1 408/4885KDM4E 2892/4885HSD17B10 1181/4885
US-11787786-B2 Fused 1,4-dihydrodioxin derivatives as inhibitors of heat shock transcription factor 1 HSF1, HSP90AB1, HSPB1 ALDH1A1 408/4885KDM4E 2892/4885HSD17B10 1181/4885
US-20220220097-A1 FUSED 1,4-DIHYDRODIOXIN DERIVATIVES AS INHIBITORS OF HEAT SHOCK TRANSCRIPTION FACTOR 1 HSF1, HSP90AB1, HSPB1 ALDH1A1 408/4885KDM4E 2892/4885HSD17B10 1181/4885

“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.