SCHEMBL14814910

SCHEMBL14814910

CC(C)(C)OC(=O)N(Nc1nc(-c2ccccc2)c(C(=O)O)s1)C(=O)OC(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.46
NPSR1 Q6W5P4 4/20 0.46
LMNA P02545 3/20 0.46
HTT P42858 2/20 0.46
MAPT P10636 1/20 0.46
ALDH1A1 P00352 4/20 0.44
KMT2A Q03164 3/20 0.44
NPC1 O15118 3/20 0.44
RAB9A P51151 2/20 0.44
DHODH Q02127 3/20 0.44
MEN1 O00255 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
ADORA3 P0DMS8 5/20 0.43
ADORA2B P29275 2/20 0.43
ADORA1 P30542 3/20 0.42
CDC7 O00311 1/20 0.42
DBF4 Q9UBU7 1/20 0.42
GSTO1 P78417 1/20 0.41

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
SCHEMBL14827149 0.92 KMT2A (0.55) SMN1; SMN2NPSR1LMNAHTTMAPT
SCHEMBL14814557 0.87 DHODH (0.63) NPSR1ALDH1A1KMT2ADHODHMEN1
SCHEMBL14814999 0.82 MEN1 (0.51) SMN1; SMN2NPSR1LMNAHTTMAPT
SCHEMBL1539910 0.80 KMT2A (0.47) SMN1; SMN2NPSR1LMNAHTTMAPT
SCHEMBL14814993 0.79 DHODH (0.47) SMN1; SMN2NPSR1LMNAHTTMAPT
Hydrochloric Acid SCHEMBL1539902 0.79 KMT2A (0.46) SMN1; SMN2NPSR1LMNAHTTMAPT
SCHEMBL14833280 0.76 DHODH (0.45) SMN1; SMN2NPSR1LMNAHTTMAPT
SCHEMBL14814909 0.76 MAPT (0.51) SMN1; SMN2LMNAMAPTALDH1A1KMT2A
SCHEMBL15064944 0.72 KMT2A (0.70) SMN1; SMN2NPSR1LMNAHTTMAPT
SCHEMBL15948911 0.71 ALDH1A1 (0.56) SMN1; SMN2NPSR1LMNAHTTMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013049585-A1 ARYLSUBSTITUTED THIAZOLOTRIAZOLES AND THIAZOLOIMIDAZOLES HENGRUI (USA), LTD. (US) 2013-04-04 WO disclosed
US-20130085157-A1 ARYLSUBSTITUTED THIAZOLOTRIAZOLES AND THIAZOLOIMIDAZOLES SMITH EMILIE D (US) 2013-04-04 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 (1 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-20130085157-A1 ARYLSUBSTITUTED THIAZOLOTRIAZOLES AND THIAZOLOIMIDAZOLES TGM2, CCT5, TSHR SMN1; SMN2 2309/4885NPSR1 2759/4885LMNA 4530/4885

“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.