SCHEMBL10065754

SCHEMBL10065754

CCCCC1COC(C)(C)O1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
CA2 P00918 2/20 0.43
EPHX1 P07099 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM5 P08912 1/20 0.33
CHRM3 P20309 1/20 0.33
TMEM97 Q5BJF2 2/20 0.33
SIGMAR1 Q99720 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.31
CYP1A2 P05177 3/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
KDM4E B2RXH2 1/20 0.31
TP53 P04637 1/20 0.31
CYP3A4 P08684 1/20 0.31
MAPT P10636 1/20 0.31
PKM P14618 1/20 0.31
HPGD P15428 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
SCHEMBL13637952 1.00 ALDH1A1 (0.43) ALDH1A1CA2EPHX1NPSR1CHRM2
SCHEMBL10972837 0.94 ALDH1A1 (0.52) ALDH1A1CA2EPHX1NPSR1CHRM2
SCHEMBL12059431 0.94 ALDH1A1 (0.52) ALDH1A1CA2EPHX1NPSR1CHRM2
SCHEMBL31362255 0.92 ALDH1A1 (0.55) ALDH1A1CA2EPHX1NPSR1CYP1A2
SCHEMBL10975960 0.92 ALDH1A1 (0.55) ALDH1A1CA2EPHX1NPSR1CYP1A2
SCHEMBL11410475 0.92 ALDH1A1 (0.55) ALDH1A1CA2EPHX1NPSR1CYP1A2
SCHEMBL10974424 0.92 ALDH1A1 (0.55) ALDH1A1CA2EPHX1NPSR1CYP1A2
SCHEMBL31362247 0.92 ALDH1A1 (0.55) ALDH1A1CA2EPHX1NPSR1CYP1A2
SCHEMBL13130046 0.89 CA2 (0.47) ALDH1A1CA2NPSR1CHRM2CHRM4
SCHEMBL8330854 0.87 CA2 (0.46) ALDH1A1CA2NPSR1CHRM2CHRM4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11687000-B2 Sulfonium compound, chemically amplified resist composition, and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-06-27 US disclosed
US-9815834-B2 Quinolone derivatives as fibroblast growth factor receptor inhibitors PRINCIPIA BIOPHARMA, INC. (US) 2017-11-14 US disclosed
US-8262391-B2 Dental composition based on silicone crosslinkable by cation process BLUESTAR SILICONES FRANCE SAS (FR) 2012-09-11 US disclosed
US-8262391-B2 Dental composition based on silicone crosslinkable by cation process BLUESTAR SILICONES FRANCE SAS (FR) 2012-09-11 US disclosed
US-20120053356-A1 NOVEL ENERGETIC POLYPHOSPHAZENES THE SECRETARY OF STATE FOR DEFENSE (GB) 2012-03-01 US disclosed
US-7893129-B2 Stable, cationically polymerizable/crosslinkable dental compositions BLUESTAR SILICONES FRANCE SAS (FR) 2011-02-22 US disclosed
US-7893129-B2 Stable, cationically polymerizable/crosslinkable dental compositions BLUESTAR SILICONES FRANCE SAS (FR) 2011-02-22 US disclosed
US-20090258961-A1 STABLE, CATIONICALLY POLYMERIZABLE/CROSSLINKABLE DENTAL COMPOSITIONS BLUESTAR SILICONES FRANCE SAS 2009-10-15 US disclosed
US-20090258961-A1 STABLE, CATIONICALLY POLYMERIZABLE/CROSSLINKABLE DENTAL COMPOSITIONS BLUESTAR SILICONES FRANCE SAS 2009-10-15 US disclosed
US-20070269664-A1 Gas Barrier Laminated Film and Process for Producing the Same SAI NIPPON PRINTING CO., LTD. (JP) 2007-11-22 US disclosed
US-20070269664-A1 Gas Barrier Laminated Film and Process for Producing the Same SAI NIPPON PRINTING CO., LTD. (JP) 2007-11-22 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 (3 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-20070269664-A1 Gas Barrier Laminated Film and Process for Producing the Same CDH1, VIL1, TET1 ALDH1A1 2903/4885CA2 774/4885EPHX1 1271/4885
US-11687000-B2 Sulfonium compound, chemically amplified resist composition, and patterning process ETV6, PKD1, PKD2 ALDH1A1 3150/4885CA2 3097/4885EPHX1 3046/4885
US-20120053356-A1 NOVEL ENERGETIC POLYPHOSPHAZENES ACLY, PEBP1, DDX42 ALDH1A1 4205/4885CA2 2462/4885EPHX1 607/4885

“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.