SCHEMBL19209480

SCHEMBL19209480

CCOC(=O)c1c(C)n[nH]c1-c1ccccc1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 2/20 0.59
SMN1; SMN2 Q16637 5/20 0.58
ALDH1A1 P00352 5/20 0.58
KDM4E B2RXH2 4/20 0.58
LMNA P02545 4/20 0.58
MAPT P10636 3/20 0.58
RAB9A P51151 2/20 0.58
GAA P10253 2/20 0.58
HPGD P15428 2/20 0.58
NPC1 O15118 2/20 0.58
NPSR1 Q6W5P4 1/20 0.58
HSD17B10 Q99714 2/20 0.56
TP53 P04637 1/20 0.56
MAPK10 P53779 2/20 0.55
HTT P42858 1/20 0.55
ADORA3 P0DMS8 4/20 0.55
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
HPGDS O60760 1/20 0.51
TSHR P16473 2/20 0.48

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
SCHEMBL13495378 0.85 SMN1; SMN2 (0.52) PDE4DSMN1; SMN2ALDH1A1KDM4ELMNA
SCHEMBL28346436 0.82 SMN1; SMN2 (0.50) SMN1; SMN2ALDH1A1KDM4ELMNAMAPT
Hydrochloric Acid SCHEMBL7409288 0.81 PDE4D (0.48) PDE4DSMN1; SMN2ALDH1A1KDM4ELMNA
SCHEMBL13615358 0.81 CHEK1 (0.46) SMN1; SMN2ALDH1A1KDM4ELMNARAB9A
SCHEMBL17279852 0.81 HPGDS (0.60) SMN1; SMN2ALDH1A1KDM4ELMNAMAPT
SCHEMBL6852749 0.79 KDM4E (0.57) SMN1; SMN2ALDH1A1KDM4ELMNAMAPT
SCHEMBL28849703 0.78 KMT2A (0.46) SMN1; SMN2ALDH1A1KDM4ERAB9AGAA
SCHEMBL10172622 0.78 KDM4E (0.56) SMN1; SMN2ALDH1A1KDM4ELMNAMAPT
SCHEMBL21331813 0.77 KDM4E (0.55) SMN1; SMN2ALDH1A1KDM4ELMNAMAPT
SCHEMBL11351745 0.77 ALDH1A1 (0.58) PDE4DSMN1; SMN2ALDH1A1KDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11339130-B1 Calpain modulators and therapeutic uses thereof BLADE THERAPEUTICS, INC. (US) 2022-05-24 US disclosed
US-10934261-B2 Calpain modulators and therapeutic uses thereof BLADE THERAPEUTICS, INC. (US) 2021-03-02 US disclosed
US-10894776-B2 2021-01-19 US disclosed
EP-3411375-B1 PYRAZOLE DERIVATIVES AS PHOSPHOINOSITIDE 3-KINASES INHIBITORS CHIESI FARM SPA (IT) 2020-08-05 EP disclosed
US-10189844-B2 Pyrazole derivatives as phosphoinositide 3-kinases inhibitors CHIESI FARMACEUTICI S.P.A. (IT) 2019-01-29 US disclosed
EP-3411375-A1 PYRAZOLE DERIVATIVES AS PHOSPHOINOSITIDE 3-KINASES INHIBITORS Chiesi Farmaceutici S.p.A. (IT) 2018-12-12 EP disclosed
WO-2017134053-A1 PYRAZOLE DERIVATIVES AS PHOSPHOINOSITIDE 3-KINASES INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2017-08-10 WO disclosed
US-20170226109-A1 PYRAZOLE DERIVATIVES AS PHOSPHOINOSITIDE 3-KINASES INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2017-08-10 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 (5 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-10934261-B2 Calpain modulators and therapeutic uses thereof CAPNS1, CAPN9, CAPN1 PDE4D 1079/4885SMN1; SMN2 200/4885ALDH1A1 4193/4885
US-10894776-B2 CAPNS1, CAPN9, CAPN2 PDE4D 1041/4885SMN1; SMN2 263/4885ALDH1A1 4421/4885
US-10189844-B2 Pyrazole derivatives as phosphoinositide 3-kinases inhibitors PI4KA, PI4KB, PI4K2B PDE4D 1315/4885SMN1; SMN2 3039/4885ALDH1A1 3454/4885
US-11339130-B1 Calpain modulators and therapeutic uses thereof CAPNS1, CAPN9, CAPN1 PDE4D 1079/4885SMN1; SMN2 200/4885ALDH1A1 4193/4885
US-20170226109-A1 PYRAZOLE DERIVATIVES AS PHOSPHOINOSITIDE 3-KINASES INHIBITORS PI4KA, PI4KB, PI4K2B PDE4D 1315/4885SMN1; SMN2 3039/4885ALDH1A1 3454/4885

“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.