SCHEMBL2672141

SCHEMBL2672141

CC(C)(C)C1(C(C)(C)C)C2(CC(=O)O)CC3CC(C2)CC1(CC(=O)O)C3

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.42
ALDH1A1 P00352 3/20 0.37
TSHR P16473 1/20 0.37
HSD11B1 P28845 6/20 0.36
GAA P10253 1/20 0.36
LMNA P02545 1/20 0.33
PKM P14618 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CYP1A2 P05177 1/20 0.33
KDM4E B2RXH2 1/20 0.32
HTT P42858 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
SCHEMBL702569 0.71 ALDH1A1 (0.33) POLBALDH1A1GAALMNAPKM
SCHEMBL7895367 0.71 EPHX2 (0.34) POLBALDH1A1TSHR
SCHEMBL5973594 0.70 POLB (0.63) POLBALDH1A1TSHRGAALMNA
Hydrochloric Acid SCHEMBL4140930 0.69 HSD11B1 (0.42) POLBALDH1A1HSD11B1SMN1; SMN2
SCHEMBL13589979 0.66 POLB (0.75) POLBALDH1A1TSHRGAALMNA
SCHEMBL29838840 0.66 POLB (0.75) POLBALDH1A1TSHRGAALMNA
SCHEMBL14433714 0.66 POLB (0.75) POLBALDH1A1TSHRGAALMNA
SCHEMBL14493662 0.66 POLB (0.75) POLBALDH1A1TSHRGAALMNA
SCHEMBL1058665 0.66 POLB (0.75) POLBALDH1A1TSHRGAALMNA
Adamantaneacetic Acid SCHEMBL24688608 0.65 ALDH1A1 (0.62) POLBALDH1A1TSHRHSD11B1SMN1; 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8173351-B2 Compound and radiation-sensitive composition JSR CORPORATION (JP) 2012-05-08 US disclosed
US-20090274977-A1 COMPOUND AND RADIATION-SENSITIVE COMPOSITION JSR CORPORATION (JP) 2009-11-05 US disclosed
EP-2100870-A1 COMPOUND AND RADIATION-SENSITIVE COMPOSITION JSR Corporation (JP) 2009-09-16 EP disclosed
US-6180316-B1 SUITABLE FOR USE AS CHEMICALLY AMPLIFIED RESIST USED IN MANUFACTURING OF INTEGRATED CIRCUITS JSR CORPORATION (JP) 2001-01-30 US disclosed
EP-0930541-A1 Radiation sensitive resin composition JSR Corporation (JP) 1999-07-21 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-20090274977-A1 COMPOUND AND RADIATION-SENSITIVE COMPOSITION RAD51, SLC11A2, XRCC6 POLB 723/4885ALDH1A1 2392/4885TSHR 3570/4885

“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.