SCHEMBL21678005

SCHEMBL21678005

CC(C)c1cc(CCc2ccccc2)c(O)cc1O

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 2/20 0.51
HSP90AA1 P07900 6/20 0.49
HSP90AB1 P08238 3/20 0.46
GABRA1 P14867 1/20 0.41
GABRB2 P47870 1/20 0.41
TRPA1 O75762 1/20 0.41
BCL2 P10415 1/20 0.39
BCL2L1 Q07817 1/20 0.39
IGF1R P08069 1/20 0.39
ALOX15 P16050 1/20 0.39
ALOX5 P09917 1/20 0.39

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
SCHEMBL21644526 0.85 PTGS1 (0.47) TRPV1HSP90AA1HSP90AB1TRPA1ALOX15
SCHEMBL30779600 0.85 PTGS1 (0.47) TRPV1HSP90AA1HSP90AB1TRPA1ALOX15
SCHEMBL21644611 0.81 HSP90AA1 (0.54) HSP90AA1HSP90AB1IGF1RALOX15
SCHEMBL30779644 0.81 HSP90AA1 (0.54) HSP90AA1HSP90AB1IGF1RALOX15
SCHEMBL9156902 0.80 BCL2 (0.58) BCL2BCL2L1IGF1RALOX15ALOX5
SCHEMBL20920805 0.79 IGF1R (0.53) HSP90AA1GABRA1GABRB2IGF1RALOX15
SCHEMBL8409221 0.75 GABRA1 (0.53) TRPV1GABRA1GABRB2TRPA1
SCHEMBL31603746 0.75 GABRA1 (0.53) TRPV1GABRA1GABRB2TRPA1
SCHEMBL1343616 0.74 HTR1A (0.44) GABRA1GABRB2
SCHEMBL29511190 0.74 HTR1A (0.44) GABRA1GABRB2

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-20200039923-A1 HEAT SHOCK PROTEIN 90 INHIBITORS TAIPEI MEDICAL UNIVERSITY (TW) 2020-02-06 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-20200039923-A1 HEAT SHOCK PROTEIN 90 INHIBITORS HSP90AB1, HSP90AB2P, HSP90AA1 TRPV1 3227/4885HSP90AA1 3/4885HSP90AB1 1/4885

“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.