SCHEMBL10144696

SCHEMBL10144696

CCOc1ccc(C2NC(=S)NC(C)=C2C(=O)Nc2cc(C)ccc2C)cc1

nearest known ligand 0.64

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.61
ALDH1A1 P00352 12/20 0.60
SMN1; SMN2 Q16637 1/20 0.56
MAPT P10636 2/20 0.54
LMNA P02545 3/20 0.53
HPGD P15428 2/20 0.53
ALOX12 P18054 1/20 0.53
HTT P42858 2/20 0.50
EGFR P00533 1/20 0.50
ABCB1 P08183 2/20 0.49
KDM4E B2RXH2 2/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
GPR55 Q9Y2T6 1/20 0.48
ALOX15 P16050 1/20 0.48
HSD17B10 Q99714 1/20 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
SCHEMBL2129265 0.84 ALDH1A1 (0.63) GAAALDH1A1SMN1; SMN2MAPTLMNA
SCHEMBL13419901 0.79 ALDH1A1 (0.63) GAAALDH1A1SMN1; SMN2MAPTHTT
SCHEMBL10113701 0.75 ADORA2B (0.64) GAAALDH1A1HTT
SCHEMBL7691437 0.72 ALDH1A1 (0.65) GAAALDH1A1SMN1; SMN2MAPTEGFR
SCHEMBL28558189 0.71 DHFR (0.81) GAAALDH1A1LMNAHPGDALOX12
SCHEMBL3168404 0.69 CA1 (0.79) GAAALDH1A1LMNAHPGDHTT
SCHEMBL7695807 0.68 GAA (0.63) GAAALDH1A1SMN1; SMN2MAPTLMNA
SCHEMBL10113412 0.68 CA1 (0.74) GAAALDH1A1SMN1; SMN2MAPTLMNA
SCHEMBL10113002 0.68 DHFR (0.72) ALDH1A1SMN1; SMN2LMNAALOX12HTT
SCHEMBL7695378 0.67 ALDH1A1 (0.67) GAAALDH1A1SMN1; SMN2MAPTLMNA

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 98/4885ALDH1A1 2125/4885SMN1; SMN2 4780/4885

“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.