SCHEMBL10143979

SCHEMBL10143979

C=C(C)CNC(=S)NNC(=O)c1ccco1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 10/20 1.00
TP53 P04637 2/20 0.66
ALPL P05186 1/20 0.66
SMN1; SMN2 Q16637 2/20 0.64
HTT P42858 3/20 0.56
KMT2A Q03164 4/20 0.56
MEN1 O00255 2/20 0.56
CYP2C9 P11712 1/20 0.56
ALDH1A1 P00352 6/20 0.55
RAB9A P51151 1/20 0.55
MAPT P10636 3/20 0.54
KDM4E B2RXH2 3/20 0.52
LMNA P02545 2/20 0.52
TDP1 Q9NUW8 2/20 0.52
L3MBTL1 Q9Y468 2/20 0.52
POLB P06746 1/20 0.52
HPGD P15428 1/20 0.52
NPC1 O15118 1/20 0.51
CRHBP P24387 1/20 0.51
CRHR2 Q13324 1/20 0.51

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
SCHEMBL11375552 0.78 KMT2A (0.66) GAATP53ALPLSMN1; SMN2HTT
SCHEMBL10816877 0.72 HTT (0.54) GAASMN1; SMN2HTTKMT2AMEN1
SCHEMBL13074753 0.71 ALDH1A1 (0.64) GAATP53SMN1; SMN2KMT2AMEN1
SCHEMBL27405353 0.71 SMN1; SMN2 (0.62) GAATP53ALPLSMN1; SMN2HTT
SCHEMBL14572489 0.70 ALDH1A1 (0.57) GAATP53SMN1; SMN2HTTKMT2A
SCHEMBL4587893 0.69 ALDH1A1 (0.70) SMN1; SMN2KMT2AMEN1ALDH1A1RAB9A
SCHEMBL13484481 0.69 SMN1; SMN2 (0.62) GAATP53SMN1; SMN2KMT2AMEN1
SCHEMBL27996731 0.69 SMN1; SMN2 (0.73) GAASMN1; SMN2KMT2AMEN1CYP2C9
SCHEMBL2567185 0.69
SCHEMBL30864915 0.69 KMT2A (0.77) GAASMN1; SMN2HTTKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120100609-A1 N-LINKED GLYCAN BIOSYNTHESIS MODULATORS BIOMARIN PHARMACEUTICAL INC. 2012-04-26 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-20120100609-A1 N-LINKED GLYCAN BIOSYNTHESIS MODULATORS ENGASE, GALNT1, GALNT13 GAA 98/4885TP53 4190/4885ALPL 2679/4885

“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.