SCHEMBL21103925

SCHEMBL21103925

CC(=O)c1cc(C(C)(C)CC(C)I)ccc1O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 2/20 0.41
HSP90AB1 P08238 2/20 0.41
PLG P00747 2/20 0.39
KLK1 P06870 2/20 0.39
KLK6 Q92876 2/20 0.39
KLKB1 P03952 1/20 0.39
ALOX15 P16050 2/20 0.36
ALOX12 P18054 1/20 0.36
CA12 O43570 2/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
CA7 P43166 2/20 0.36
CA9 Q16790 2/20 0.36
CA14 Q9ULX7 2/20 0.36
RORC P51449 1/20 0.36
MAOA P21397 2/20 0.35
MAOB P27338 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
HTT P42858 2/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL23366127 0.81 ALOX15 (0.52) HSP90AA1HSP90AB1ALOX15ALOX12RORC
SCHEMBL13898693 0.80 HSP90AA1 (0.50) HSP90AA1HSP90AB1PLGKLK1KLK6
SCHEMBL6581882 0.76 HSP90AA1 (0.60) HSP90AA1HSP90AB1PLGKLK1KLK6
SCHEMBL18574474 0.75 HSD17B2 (0.46) ALOX15ALOX12MAOBLMNAMAPK1
SCHEMBL13609958 0.74 ESR1 (0.53) HSP90AA1HSP90AB1PLGKLK1KLK6
SCHEMBL9700637 0.72 CNR2 (0.55)
SCHEMBL18574477 0.72 SHBG (0.53) LMNAALDH1A1HPGD
SCHEMBL11552788 0.71 HSP90AA1 (0.44) HSP90AA1HSP90AB1PLGKLK1KLK6
SCHEMBL8747175 0.71 CHEK1 (0.47) HSP90AA1HSP90AB1PLGKLK1KLK6
SCHEMBL320481 0.71 CES2 (0.52) HTTALDH1A1MAPTHPGDL3MBTL1

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-10324374-B2 Active light sensitive or radiation sensitive resin composition, active light sensitive or radiation sensitive film, mask blank provided with active light sensitive or radiation sensitive film, pattern forming method, method for manufacturing electronic device, electronic device and novel compound FUJIFILM CORPORATION (JP) 2019-06-18 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-10324374-B2 Active light sensitive or radiation sensitive resin composition, active light sensitive or radiation sensitive film, mask blank provided with active light sensitive or radiation sensitive film, pattern forming method, method for manufacturing electronic device, electronic device and novel compound ERCC1, RER1, ECPAS HSP90AA1 454/4885HSP90AB1 693/4885PLG 672/4885

“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.