SCHEMBL26824324

SCHEMBL26824324

CC(C)CC1(CC(C)C)OC(OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H](C)[C@H]1C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LGALS9 O00182 1/20 0.38
▸ LGALS1 P09382 1/20 0.38
▸ LGALS3 P17931 1/20 0.38
▸ LGALS7; LGALS7B P47929 1/20 0.38
▸ BCHE P06276 2/20 0.37
▸ PTGES2 Q9H7Z7 1/20 0.36
▸ TRPM8 Q7Z2W7 1/20 0.36
▸ ABCB1 P08183 6/20 0.35
▸ GAA P10253 1/20 0.35
▸ ADRB2 P07550 2/20 0.34
▸ ADRB1 P08588 2/20 0.34
▸ ADRB3 P13945 2/20 0.34
▸ HTR3E A5X5Y0 1/20 0.34
▸ HTR3B O95264 1/20 0.34
▸ CHRNA7 P36544 1/20 0.34
▸ HTR3A P46098 1/20 0.34
▸ HTR3D Q70Z44 1/20 0.34
▸ HTR3C Q8WXA8 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ CYP1A2 P05177 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
SCHEMBL26824107 0.76 GAA (0.42) BCHEPTGES2ABCB1GAAHTR3E
SCHEMBL26824308 0.73 LGALS9 (0.42) LGALS9LGALS1LGALS3LGALS7; LGALS7BBCHE
SCHEMBL26824285 0.73 LGALS9 (0.42) LGALS9LGALS1LGALS3LGALS7; LGALS7BBCHE
SCHEMBL26823569 0.73 GAA (0.43) LGALS9LGALS1LGALS3LGALS7; LGALS7BPTGES2
SCHEMBL26823554 0.73 GAA (0.43) LGALS9LGALS1LGALS3LGALS7; LGALS7BPTGES2
SCHEMBL26823559 0.73 GAA (0.43) LGALS9LGALS1LGALS3LGALS7; LGALS7BPTGES2
SCHEMBL14929138 0.73 GAA (0.44) LGALS9LGALS1LGALS3LGALS7; LGALS7BBCHE
SCHEMBL26268684 0.73 ABCB1 (0.47) ABCB1GAA
SCHEMBL17861870 0.71 HTR3E (0.37) LGALS9LGALS1LGALS3LGALS7; LGALS7BBCHE
SCHEMBL6098831 0.71 ABCB1 (0.43) ABCB1

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-11827664-B2 Biaryl amides with modified sugar groups for treatment of diseases associated with heat shock protein pathway REATA PHARMACEUTICALS, INC (US) 2023-11-28 — — 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-11827664-B2 Biaryl amides with modified sugar groups for treatment of diseases associated with heat shock protein pathway HSPA2, HSP90AB2P, HSF1 LGALS9 3109/4885LGALS1 2570/4885LGALS3 1442/4885

“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.

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