SCHEMBL10033969

SCHEMBL10033969

CC1(C)CCCC(C)(C)N1/N=N/c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.39
TDP1 Q9NUW8 3/20 0.33
TSHR P16473 2/20 0.33
MAPK1 P28482 2/20 0.33
HSD17B10 Q99714 1/20 0.33
NPC1 O15118 6/20 0.32
MAPT P10636 5/20 0.32
RAB9A P51151 5/20 0.32
MEN1 O00255 4/20 0.32
KMT2A Q03164 4/20 0.32
PKM P14618 2/20 0.32
HTT P42858 2/20 0.32
GAA P10253 2/20 0.31
CYP1A1 P04798 1/20 0.31
CYP1B1 Q16678 1/20 0.31
SMN1; SMN2 Q16637 3/20 0.30
L3MBTL1 Q9Y468 2/20 0.30
LMNA P02545 1/20 0.30
CASP6 P55212 1/20 0.30

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
SCHEMBL10033970 1.00 ALDH1A1 (0.39) ALDH1A1TDP1TSHRMAPK1HSD17B10
SCHEMBL10033963 0.84 MAPT (0.36) ALDH1A1TDP1MAPK1NPC1MAPT
SCHEMBL10066073 0.82 MAPT (0.44) ALDH1A1MAPK1MAPTSMN1; SMN2L3MBTL1
SCHEMBL537707 0.77 ALDH1A1 (0.36) ALDH1A1TDP1TSHRMAPK1HSD17B10
SCHEMBL10033965 0.68 TSHR (0.60) ALDH1A1TDP1TSHRHSD17B10MAPT
SCHEMBL10033964 0.66 TSHR (0.30) TSHR
SCHEMBL10033967 0.66
SCHEMBL11657921 0.66 ALDH1A1 (0.37) ALDH1A1TSHRMAPK1HSD17B10MEN1
SCHEMBL6093250 0.66 MAPT (0.61) ALDH1A1NPC1MAPTRAB9AMEN1
SCHEMBL410238 0.66 GSK3A (0.37) ALDH1A1TSHRMAPK1HSD17B10GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8940806-B2 Polymerizable compositions BASF SE (DE) 2015-01-27 US disclosed
US-8940806-B2 Polymerizable compositions BASF SE (DE) 2015-01-27 US disclosed
US-20120041093-A1 POLYMERIZABLE COMPOSITIONS BASF SE (DE) 2012-02-16 US disclosed
US-20120041093-A1 POLYMERIZABLE COMPOSITIONS BASF SE (DE) 2012-02-16 US disclosed
WO-2010112410-A1 POLYMERIZABLE COMPOSITIONS BASF SE (DE) 2010-10-07 WO 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-20120041093-A1 POLYMERIZABLE COMPOSITIONS H1-10, CBR1, NR1H2 ALDH1A1 3185/4885TDP1 4185/4885TSHR 1205/4885

“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.