SCHEMBL10144756

SCHEMBL10144756

C=CCOc1ccc(C2NC(=S)NC(C)=C2C(=O)OC)cc1OC

nearest known ligand 0.76

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.76
GAA P10253 4/20 0.65
CA1 P00915 2/20 0.60
CA2 P00918 2/20 0.60
ALOX12 P18054 1/20 0.58
HTT P42858 1/20 0.58
MAPT P10636 2/20 0.58
EGFR P00533 1/20 0.54
RAB9A P51151 2/20 0.53
KDM4E B2RXH2 1/20 0.53
NPC1 O15118 1/20 0.53
TSHR P16473 3/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
LMNA P02545 1/20 0.52
HSD17B10 Q99714 1/20 0.52
GUSB P08236 1/20 0.52

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
SCHEMBL10112913 0.84 GAA (0.74) ALDH1A1GAAHTTMAPTRAB9A
SCHEMBL4669190 0.81 ALDH1A1 (0.67) ALDH1A1GAACA1CA2ALOX12
SCHEMBL10113522 0.81 ALDH1A1 (0.61) ALDH1A1GAACA1CA2ALOX12
SCHEMBL13419868 0.77 GAA (0.70) ALDH1A1GAACA1CA2HTT
SCHEMBL26671671 0.75 ALDH1A1 (0.64) ALDH1A1GAACA1CA2ALOX12
SCHEMBL7690365 0.74 GUSB (0.74) ALDH1A1GAACA1CA2ALOX12
SCHEMBL10113658 0.74 CA1 (0.77) ALDH1A1CA1CA2ALOX12HTT
SCHEMBL13419901 0.74 ALDH1A1 (0.63) ALDH1A1GAACA1CA2HTT
SCHEMBL10112742 0.74 ALDH1A1 (0.58) ALDH1A1CA1CA2ALOX12HTT
SCHEMBL10113582 0.73 CA1 (0.67) ALDH1A1CA1CA2ALOX12HTT

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 ALDH1A1 2125/4885GAA 98/4885CA1 3782/4885

“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.