SCHEMBL3042909

SCHEMBL3042909

CCOP(=O)(Cc1cc(OC)c(CP(=O)(OCC)OCC)cc1OC)OCC

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.41
TSHR P16473 1/20 0.41
CCNT1 O60563 3/20 0.41
CDK9 P50750 3/20 0.41
EGFR P00533 2/20 0.40
MAPT P10636 1/20 0.40
CYP3A4 P08684 1/20 0.39
HTT P42858 1/20 0.39
PPARD Q03181 1/20 0.36
HTR2A P28223 1/20 0.35

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
SCHEMBL12892630 0.96 TAAR1 (0.49) TAAR1L3MBTL1TSHRCCNT1CDK9
SCHEMBL12215858 0.93 TAAR1 (0.39) TAAR1L3MBTL1TSHRCCNT1CDK9
SCHEMBL13904866 0.86 CCNT1 (0.35) TAAR1L3MBTL1TSHRCCNT1CDK9
SCHEMBL6298899 0.85 EGFR (0.43) L3MBTL1TSHRCCNT1CDK9EGFR
SCHEMBL13018894 0.83 CCNT1 (0.44) L3MBTL1CCNT1CDK9EGFRMAPT
SCHEMBL15515807 0.83 HTR2A (0.40) L3MBTL1TSHRCCNT1CDK9EGFR
SCHEMBL23525666 0.82 CCNT1 (0.39) L3MBTL1CCNT1CDK9EGFRMAPT
SCHEMBL30791331 0.82 CCNT1 (0.39) L3MBTL1CCNT1CDK9EGFRMAPT
SCHEMBL23364293 0.82 KDM4E (0.44) L3MBTL1TSHRMAPTHTT
SCHEMBL11070999 0.82 LMNA (0.41) L3MBTL1CCNT1CDK9EGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100221180-A1 IN VIVO IMAGING OF MYELINATION WANG YANMING 2010-09-02 US disclosed
US-20100221180-A1 IN VIVO IMAGING OF MYELINATION WANG YANMING 2010-09-02 US disclosed
US-20100207078-A1 DEPROTECTION OF FUNCTIONAL GROUPS BY MULTI-PHOTON INDUCED ELECTRON TRANSFER THE ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA 2010-08-19 US disclosed
US-20100207078-A1 DEPROTECTION OF FUNCTIONAL GROUPS BY MULTI-PHOTON INDUCED ELECTRON TRANSFER THE ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA 2010-08-19 US disclosed
US-7718760-B2 π-Conjugated polymer and manufacturing method thereof RICOH COMPANY, LTD. (JP) 2010-05-18 US disclosed
US-20090218564-A1 Alternating copolymers of phenylene vinylene and biarylene vinylene, preparation method thereof, and organic thin flim transister comprising the same SAMSUNG ELECTRONICS CO., LTD. 2009-09-03 US disclosed
US-7550554-B2 Aryl amine polymer, thin film transistor using the new aryl amine polymer, and method of manufacturing the thin film transistor RICOH COMPANY, LTD. (JP) 2009-06-23 US disclosed
WO-2009029936-A1 IN VIVO IMAGING OF MYELIN CASE WESTERN RESERVE UNIVERSITY (US) 2009-03-05 WO disclosed
WO-2008008481-A2 DEPROTECTION OF FUNCTIONAL GROUPS BY MULTI-PHOTON INDUCED ELECTRON TRANSFER GEORGIA TECH RESEARCH CORPORATION (US) 2008-01-17 WO disclosed
US-20070092760-A1 NEW ARYL AMINE POLYMER, THIN FILM TRANSISTOR USING THE NEW ARYL AMINE POLYMER, AND METHOD OF MANUFACTURING THE THIN FILM TRANSISTOR SAGISAKA TOSHIYA 2007-04-26 US disclosed
US-7166689-B2 Aryl amine polymer, thin film transistor using the aryl amine polymer, and method of manufacturing the thin film transistor RICOH COMPANY, LTD. (JP) 2007-01-23 US disclosed
US-6316591-B1 FOR USE IN LIGHTING OR DISPLAY DEVICES; SOLID-STATE LIGHT SOURCES AVENTIS RESEARCH & TECHNOLOGIES GMBH & CO. KG (DE) 2001-11-13 US disclosed
US-5814244-A POLYARYLENEVINYLENES, LOW THRESHOLD VOLTAGE AND HIGH EFFICIENCY HOECHST AKTIENGESELLSCHAFT (DE) 1998-09-29 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 (2 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-20100221180-A1 IN VIVO IMAGING OF MYELINATION MAG, PMP22, MYT1 TAAR1 837/4885L3MBTL1 1202/4885TSHR 4529/4885
US-20100207078-A1 DEPROTECTION OF FUNCTIONAL GROUPS BY MULTI-PHOTON INDUCED ELECTRON TRANSFER GPX4, ERCC4, CYBA TAAR1 4863/4885L3MBTL1 1826/4885TSHR 4825/4885

“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.