SCHEMBL19974212

SCHEMBL19974212

O=C(O)/C=C/C(=O)Nc1nc(-c2ccncc2)cs1

nearest known ligand 0.73

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.73
SMN1; SMN2 Q16637 3/20 0.73
MAPT P10636 2/20 0.73
KDM4E B2RXH2 2/20 0.73
MAPK1 P28482 2/20 0.73
PARP1 P09874 2/20 0.62
MEN1 O00255 3/20 0.60
KMT2A Q03164 3/20 0.60
HTT P42858 1/20 0.60
ROCK1 Q13464 9/20 0.60
GSTO1 P78417 1/20 0.59
PRKACA P17612 1/20 0.57
ALDH1A1 P00352 1/20 0.57
ROCK2 O75116 5/20 0.56
WNT3A P56704 1/20 0.55
RAB9A P51151 2/20 0.55
POLB P06746 1/20 0.55
HPGD P15428 1/20 0.55
NPC1 O15118 1/20 0.55

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
SCHEMBL19974213 1.00 LMNA (0.73) LMNASMN1; SMN2MAPTKDM4EMAPK1
SCHEMBL19974143 0.90 PARP1 (0.76) LMNASMN1; SMN2MAPTKDM4EMAPK1
SCHEMBL19974141 0.90 PARP1 (0.76) LMNASMN1; SMN2MAPTKDM4EMAPK1
SCHEMBL19981590 0.81 MAPT (0.60) LMNASMN1; SMN2MAPTKDM4EMAPK1
SCHEMBL19974299 0.80 ADORA3 (0.68) LMNASMN1; SMN2MAPTKDM4EMEN1
SCHEMBL19974298 0.80 ADORA3 (0.68) LMNASMN1; SMN2MAPTKDM4EMEN1
SCHEMBL10699534 0.78 ABL1 (0.73) MAPTKDM4EMAPK1PARP1MEN1
SCHEMBL12281965 0.78 ROCK1 (0.63) LMNASMN1; SMN2MAPTKDM4EMAPK1
Hydrochloric Acid SCHEMBL29633108 0.77 ROCK1 (0.62) LMNASMN1; SMN2MAPTKDM4EMAPK1
SCHEMBL1915861 0.76 GSTO1 (0.73) LMNASMN1; SMN2MAPTKDM4EMAPK1

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 LMNA 3549/4885SMN1; SMN2 4284/4885MAPT 2930/4885
US-20210221778-A1 Inhibitors of heat shock factors and uses thereof HSF1, HSP90AB2P, HSP90AB1 LMNA 3549/4885SMN1; SMN2 4284/4885MAPT 2930/4885

“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.