SCHEMBL2734498

SCHEMBL2734498

CCC(C)C(=O)OC(C)(C)C12CC3CC(CC(C(=O)O)(C3)C1)C2

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.37
PKM P14618 2/20 0.37
RBP4 P02753 1/20 0.34
NPSR1 Q6W5P4 1/20 0.33
KMT2A Q03164 1/20 0.32
LMNA P02545 1/20 0.32
GAA P10253 1/20 0.32
TSHR P16473 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
SCHEMBL12134118 0.85 ALDH1A1 (0.32) ALDH1A1KMT2AGAA
SCHEMBL12430202 0.85 DPP4 (0.36) ALDH1A1L3MBTL1PKMNPSR1TSHR
SCHEMBL111708 0.84 ALDH1A1 (0.38) ALDH1A1L3MBTL1KMT2ALMNA
SCHEMBL13241926 0.80 ALDH1A1 (0.40) ALDH1A1L3MBTL1PKMRBP4NPSR1
SCHEMBL11966903 0.76 ALDH1A1 (0.42) ALDH1A1L3MBTL1PKMNPSR1KMT2A
SCHEMBL7454685 0.76 ALDH1A1 (0.42) ALDH1A1L3MBTL1PKMRBP4NPSR1
SCHEMBL6829593 0.76 ALDH1A1 (0.42) ALDH1A1L3MBTL1PKMRBP4KMT2A
SCHEMBL13995725 0.75 DPP4 (0.31)
SCHEMBL5419562 0.75 ALDH1A1 (0.38) ALDH1A1L3MBTL1PKMRBP4NPSR1
SCHEMBL7463794 0.75 ALDH1A1 (0.43) ALDH1A1L3MBTL1PKMRBP4NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8431330-B2 Surface-treating agent for pattern formation and pattern-forming method using the surface-treating agent FUJIFILM CORPORATION (JP) 2013-04-30 US disclosed
US-20120076991-A1 SURFACE-TREATING AGENT FOR PATTERN FORMATION AND PATTERN-FORMING METHOD USING THE SURFACE-TREATING AGENT FUJIFILM CORPORATION (JP) 2012-03-29 US disclosed
US-8088566-B2 Photoresists; using compound containing an orgaooxygen or organosulfur compound FUJIFILM CORPORATION (JP) 2012-01-03 US disclosed
US-20100028803-A1 SURFACE TREATING AGENT FOR RESIST PATTERN FORMATION, RESIST COMPOSITION, METHOD OF TREATING SURFACE OF RESIST PATTERN THEREWITH AND METHOD OF FORMING RESIST PATTERN FUJIFILM CORPORATION (JP) 2010-02-04 US disclosed
US-20090280440-A1 SURFACE TREATING AGENT FOR RESIST-PATTERN, AND PATTERN-FORMING METHOD USING SAME FUJIFILM CORPORATION (JP) 2009-11-12 US disclosed
US-20080241742-A1 SURFACE-TREATING AGENT FOR PATTERN FORMATION AND PATTERN-FORMING METHOD USING THE SURFACE-TREATING AGENT FUJIFILM CORPORATION (JP) 2008-10-02 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-20080241742-A1 SURFACE-TREATING AGENT FOR PATTERN FORMATION AND PATTERN-FORMING METHOD USING THE SURFACE-TREATING AGENT KRT18, FSCN1, SLC11A2 ALDH1A1 445/4885L3MBTL1 4576/4885PKM 3959/4885

“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.