SCHEMBL2537545

SCHEMBL2537545

COC(=O)C12C[C]3CC(CC(O)(C3)C1)C2

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.36
TSHR P16473 1/20 0.36
RIN1 Q13671 1/20 0.36
ALDH1A1 P00352 2/20 0.35
CNR1 P21554 2/20 0.34
CNR2 P34972 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
NPSR1 Q6W5P4 2/20 0.33
USP2 O75604 1/20 0.33
HSD11B1 P28845 2/20 0.31
GLA P06280 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL2939176 0.89 GLA (0.35) TSHRALDH1A1NPSR1GLA
SCHEMBL5004820 0.83 ALDH1A1 (0.33) ALDH1A1NPSR1GLA
SCHEMBL4034729 0.82 MEN1 (0.35) TSHRGLANPC1SMN1; SMN2
SCHEMBL2536300 0.81 HSD11B1 (0.34) CNR2L3MBTL1HSD11B1
SCHEMBL1772638 0.76 GLA (0.42) TSHRALDH1A1CNR2L3MBTL1NPSR1
SCHEMBL5608286 0.75 ALDH1A1 (0.40) ABL1TSHRRIN1ALDH1A1CNR1
SCHEMBL5607585 0.75 ALDH1A1 (0.40) ABL1TSHRRIN1ALDH1A1CNR1
SCHEMBL503327 0.74 PKM (0.32)
SCHEMBL5608439 0.74 ALDH1A1 (0.56) ABL1TSHRRIN1ALDH1A1CNR1
SCHEMBL14633816 0.71

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130045446-A1 RADIATION-SENSITIVE RESIN COMPOSITION, METHOD FOR FORMING A RESIST PATTERN AND SULFONIUM COMPOUND JSR CORPORATION (JP) 2013-02-21 US disclosed
US-8043786-B2 Acid generators, sulfonic acids, sulfonyl halides, and radiation sensitive resin compositions JSR CORPORATION (JP) 2011-10-25 US disclosed
EP-1586594-B1 ACRYLIC COPOLYMER AND RADIATION-SENSITIVE RESIN COMPOSITION JSR CORP (JP) 2010-09-15 EP disclosed
US-7452655-B2 Acrylic copolymer and radiation-sensitive resin composition JSR CORPORATION (JP) 2008-11-18 US disclosed
US-7217492-B2 Onium salt compound and radiation-sensitive resin composition JSR CORPORATION (JP) 2007-05-15 US disclosed
US-20070054214-A1 Acid generators, sulfonic acids, sulfonyl halides, and radiation sensitive resin compositions JSR CORPORATION (JP) 2007-03-08 US disclosed
US-20060074139-A1 Acrylic copolymer and radiation-sensitive resin composition JSR CORPORATION (JP) 2006-04-06 US disclosed
EP-1600437-A1 ACID GENERATORS, SULFONIC ACIDS, SULFONYL HALIDES, AND RADIATION-SENSITIVE RESIN COMPOSITIONS JSR Corporation (JP) 2005-11-30 EP disclosed
US-20050053861-A1 Onium salt compound and radiation-sensitive resin composition JSR CORPORATION (JP) 2005-03-10 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-20130045446-A1 RADIATION-SENSITIVE RESIN COMPOSITION, METHOD FOR FORMING A RESIST PATTERN AND SULFONIUM COMPOUND RAD51, RER1, SEM1 ABL1 2510/4885TSHR 2228/4885RIN1 520/4885

“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.