SCHEMBL12858249

SCHEMBL12858249

CNC(=O)C12CC3(C)CC(C)(CC(C)(C3)C1)C2

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.53
PKM P14618 1/20 0.52
TSHR P16473 1/20 0.52
HSD17B10 Q99714 1/20 0.52
SMN1; SMN2 Q16637 3/20 0.50
ALDH1A1 P00352 1/20 0.50
ALOX12 P18054 2/20 0.43
THRB P10828 1/20 0.41
POLB P06746 1/20 0.40
GAA P10253 2/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
ALOX15 P16050 1/20 0.32
HTT P42858 1/20 0.32
MAPK1 P28482 1/20 0.32

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
SCHEMBL25975362 0.97 RAB9A (0.50) RAB9APKMTSHRHSD17B10SMN1; SMN2
SCHEMBL20103706 0.81 THRB (0.39) RAB9APKMTSHRHSD17B10SMN1; SMN2
SCHEMBL5104779 0.78 PKM (0.56) RAB9APKMTSHRHSD17B10SMN1; SMN2
SCHEMBL20416291 0.77 THRB (0.42) RAB9APKMTSHRHSD17B10SMN1; SMN2
SCHEMBL23822907 0.75 THRB (0.41) RAB9ATSHRHSD17B10THRB
SCHEMBL4449130 0.75 THRB (0.37) RAB9APKMTSHRHSD17B10SMN1; SMN2
SCHEMBL27402648 0.75 THRB (0.41) RAB9ATSHRHSD17B10THRB
Hydrochloric Acid SCHEMBL26979715 0.75 THRB (0.41) RAB9APKMTSHRHSD17B10THRB
SCHEMBL12858855 0.75 ALDH1A1 (0.70) RAB9APKMTSHRHSD17B10SMN1; SMN2
SCHEMBL12858018 0.75 RAB9A (0.69) RAB9APKMTSHRHSD17B10SMN1; SMN2

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-20110028719-A1 SCREENING METHODS FOR AMYLOID BETA MODULATORS WARATAH PHARMACEUTICALS INC. (CA) 2011-02-03 US disclosed
US-20110028719-A1 SCREENING METHODS FOR AMYLOID BETA MODULATORS WARATAH PHARMACEUTICALS INC. (CA) 2011-02-03 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-20110028719-A1 SCREENING METHODS FOR AMYLOID BETA MODULATORS APP, BACE1, IAPP RAB9A 4198/4885PKM 3506/4885TSHR 4310/4885

“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.