SCHEMBL19974299

SCHEMBL19974299

O=C(O)C=CC(=O)Nc1nc(-c2ccccn2)cs1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 7/20 0.68
KDM4A O75164 1/20 0.68
KDM4B O94953 1/20 0.68
KDM5B Q9UGL1 1/20 0.68
SMN1; SMN2 Q16637 6/20 0.67
ALDH1A1 P00352 6/20 0.67
MAPT P10636 6/20 0.67
LMNA P02545 5/20 0.67
RAB9A P51151 4/20 0.67
HTT P42858 4/20 0.67
MEN1 O00255 3/20 0.67
POLB P06746 3/20 0.67
KMT2A Q03164 3/20 0.67
NPC1 O15118 2/20 0.67
L3MBTL1 Q9Y468 4/20 0.59
HPGD P15428 1/20 0.58
SLC2A1 P11166 1/20 0.58
GRM1 Q13255 1/20 0.58
KDM4E B2RXH2 4/20 0.57
MITF O75030 1/20 0.57

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
SCHEMBL19974298 1.00 ADORA3 (0.68) ADORA3KDM4AKDM4BKDM5BSMN1; SMN2
SCHEMBL19974143 0.84 PARP1 (0.76) ADORA3SMN1; SMN2ALDH1A1MAPTLMNA
SCHEMBL19974141 0.84 PARP1 (0.76) ADORA3SMN1; SMN2ALDH1A1MAPTLMNA
SCHEMBL2998083 0.84 ADORA3 (0.79) ADORA3KDM4AKDM4BKDM5BSMN1; SMN2
SCHEMBL19981467 0.83 MAPT (0.59) ADORA3KDM4AKDM4BKDM5BSMN1; SMN2
SCHEMBL19974212 0.80 LMNA (0.73) SMN1; SMN2ALDH1A1MAPTLMNARAB9A
SCHEMBL19974213 0.80 LMNA (0.73) SMN1; SMN2ALDH1A1MAPTLMNARAB9A
SCHEMBL17716927 0.80 ALDH1A1 (0.75) ADORA3KDM4AKDM4BKDM5BSMN1; SMN2
SCHEMBL4657817 0.80 ADORA3 (0.72) ADORA3KDM4AKDM4BKDM5BSMN1; SMN2
SCHEMBL18997288 0.80 ADORA3 (0.82) ADORA3KDM4AKDM4BKDM5BSMN1; 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
EP-3512602-B1 INHIBITORS OF HEAT SHOCK FACTORS (HSF) AND USES THEREOF HSF PHARMACEUTICALS (CH) 2024-03-27 EP disclosed
US-11597708-B2 Inhibitors of heat shock factors and uses thereof HSF PHARMACEUTICALS SA (CH) 2023-03-07 US disclosed
US-20210221778-A1 Inhibitors of heat shock factors and uses thereof HSF PHARMACEUTICALS SA (CH) 2021-07-22 US disclosed
EP-3512602-A2 INHIBITORS OF HEAT SHOCK FACTORS AND USES THEREOF HSF Pharmaceuticals (CH) 2019-07-24 EP disclosed
WO-2018050656-A2 INHIBITORS OF HEAT SHOCK FACTORS AND USES THEREOF HSF PHARMACEUTICALS (CH) 2018-03-22 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-11597708-B2 Inhibitors of heat shock factors and uses thereof HSF1, HSP90AB2P, HSP90AB1 ADORA3 4538/4885KDM4A 3137/4885KDM4B 3586/4885
US-20210221778-A1 Inhibitors of heat shock factors and uses thereof HSF1, HSP90AB2P, HSP90AB1 ADORA3 4538/4885KDM4A 3137/4885KDM4B 3586/4885

“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.