SCHEMBL1833246

SCHEMBL1833246

CCOc1ccccc1P(c1ccccc1)c1ccccc1OCC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.47
L3MBTL1 Q9Y468 5/20 0.46
GLA P06280 1/20 0.46
MAPT P10636 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
TDP1 Q9NUW8 2/20 0.41
CYP3A4 P08684 1/20 0.41
ADORA3 P0DMS8 1/20 0.40
ADORA2A P29274 1/20 0.40
ADORA1 P30542 1/20 0.40
CYP2C19 P33261 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
HTR1A P08908 1/20 0.39
ADRA1D P25100 1/20 0.39
ADRA1A P35348 1/20 0.39
ADRA1B P35368 1/20 0.39
LTA4H P09960 1/20 0.38
PTPRC P08575 1/20 0.38
POLB P06746 1/20 0.38

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
SCHEMBL30707397 0.96 ALDH1A1 (0.47) ALDH1A1L3MBTL1GLAMAPTNPSR1
SCHEMBL9181053 0.96 ALDH1A1 (0.47) ALDH1A1L3MBTL1GLAMAPTNPSR1
SCHEMBL1838148 0.88 ALDH1A1 (0.54) ALDH1A1L3MBTL1GLAMAPTNPSR1
SCHEMBL20873232 0.86 ALDH1A1 (0.52) ALDH1A1L3MBTL1GLAMAPTNPSR1
SCHEMBL1835622 0.85 CYP1A2 (0.41) ALDH1A1L3MBTL1MAPTNPSR1TDP1
SCHEMBL30023141 0.84 ALDH1A1 (0.43) ALDH1A1L3MBTL1GLAMAPTNPSR1
SCHEMBL1837899 0.84 CYP1A2 (0.51) ALDH1A1L3MBTL1MAPTTDP1CYP3A4
SCHEMBL15417591 0.84 ALDH1A1 (0.43) ALDH1A1L3MBTL1GLAMAPTNPSR1
SCHEMBL30171081 0.82 ALDH1A1 (0.42) ALDH1A1L3MBTL1GLAMAPTNPSR1
SCHEMBL10382309 0.81 ALDH1A1 (0.44) ALDH1A1L3MBTL1GLAMAPTNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2321244-B1 IMPROVED PROCESS FOR TELOMERIZATION OF BUTADIENE DOW GLOBAL TECHNOLOGIES LLC (US) 2016-12-21 EP disclosed
US-8558030-B2 Process for telomerization of butadiene DOW GLOBAL TECHNOLOGIES LLC (US) 2013-10-15 US disclosed
US-20110137086-A1 PROCESS FOR TELOMERIZATION OF BUTADIENE Dow Global Technologies LLC (Formerly known as Dow Global Technologies Inc.) (US) 2011-06-09 US disclosed
EP-2321244-A2 AN IMPROVED PROCESS FOR TELOMERIZATION OF BUTADIENE Dow Global Technologies LLC (US) 2011-05-18 EP disclosed
WO-2010019360-A2 AN IMPROVED PROCESS FOR TELOMERIZATION OF BUTADIENE DOW GLOBAL TECHNOLOGIES INC. (US) 2010-02-18 WO disclosed
EP-0479541-B1 Iridium-optically active phosphine complex and catalytic production of optically active alcohols therewith TAKASAGO PERFUMERY CO LTD (JP) 1995-07-19 EP disclosed
US-5210332-A Iridium-optically active phosphine complex and process for producing optically active alcohols using the same TAKASAGO INTERNATIONAL CORPORATION (JP) 1993-05-11 US disclosed
EP-0479541-A1 Iridium-optically active phosphine complex and catalytic production of optically active alcohols therewith Takasago International Corporation (JP) 1992-04-08 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-20110137086-A1 PROCESS FOR TELOMERIZATION OF BUTADIENE HRH3, HRH4, TELO2 ALDH1A1 2964/4885L3MBTL1 4153/4885GLA 2194/4885

“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.