SCHEMBL11074730

SCHEMBL11074730

Cc1cc2nnn(CCl)c2cc1C

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 8/20 0.52
MGAM O43451 7/20 0.52
AMY1A P0DUB6 7/20 0.52
SI P14410 7/20 0.52
MGAM2 Q2M2H8 7/20 0.52
POLB P06746 1/20 0.39
NPC1 O15118 3/20 0.36
RAB9A P51151 3/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
NAMPT P43490 1/20 0.35
SLC9A1 P19634 2/20 0.35
KCNH2 Q12809 1/20 0.35
HCAR3 P49019 1/20 0.35
LMNA P02545 1/20 0.34

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
SCHEMBL14294674 0.82 SLC9A1 (0.53) GAAMGAMAMY1ASIMGAM2
SCHEMBL17103124 0.81 SLC9A1 (0.51) GAAMGAMAMY1ASIMGAM2
SCHEMBL13875211 0.81 GAA (0.55) GAAMGAMAMY1ASIMGAM2
SCHEMBL19911444 0.79 SLC9A1 (0.56) GAAMGAMAMY1ASIMGAM2
SCHEMBL19911474 0.78 NAMPT (0.49) GAAMGAMAMY1ASIMGAM2
SCHEMBL19848282 0.78 GAA (0.51) GAAMGAMAMY1ASIMGAM2
SCHEMBL19911491 0.78 POLB (0.43) GAAMGAMAMY1ASIMGAM2
SCHEMBL19911452 0.78 GRM2 (0.63) GAAMGAMAMY1ASIMGAM2
SCHEMBL19911453 0.77 GAA (0.48) GAAMGAMAMY1ASIMGAM2
SCHEMBL19915729 0.77 GAA (0.48) GAAMGAMAMY1ASIMGAM2

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
US-20180062213-A1 Nonaqueous Electrolyte and Nonaqueous Secondary Battery ASAHI KASEI KABUSHIKI KAISHA (JP) 2018-03-01 US disclosed
EP-0114675-A2 Color photographic silver halide light-sensitive material FUJI PHOTO FILM CO., LTD. (JP) 1984-08-01 EP 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-20180062213-A1 Nonaqueous Electrolyte and Nonaqueous Secondary Battery BPTF, BRD4, KCNN2 GAA 4140/4885MGAM 3479/4885AMY1A 4249/4885

“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.