SCHEMBL11962349

SCHEMBL11962349

O=P(c1cccc2ccccc12)(c1cccc2ccccc12)c1ccc2ccc3cccc4ccc1c2c34

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.52
HSD17B10 Q99714 6/20 0.52
HPGD P15428 6/20 0.52
CYP1A2 P05177 4/20 0.52
THRB P10828 1/20 0.52
ERBB2 P04626 1/20 0.52
FYN P06241 1/20 0.52
MAOA P21397 1/20 0.52
ACHE P22303 1/20 0.52
AHR P35869 1/20 0.52
KDM4E B2RXH2 3/20 0.43
POLB P06746 2/20 0.43
LMNA P02545 1/20 0.43
TSHR P16473 4/20 0.41
CYP3A4 P08684 3/20 0.41
L3MBTL1 Q9Y468 3/20 0.41
TDP1 Q9NUW8 2/20 0.41
HPRT1 P00492 1/20 0.40
CYP1A1 P04798 1/20 0.39
CYP1B1 Q16678 1/20 0.39

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
SCHEMBL9927158 1.00 ALDH1A1 (0.52) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL9927159 0.91 ALDH1A1 (0.50) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL9927191 0.90 CYP1A2 (0.46) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL11990961 0.85 CYP1A2 (0.43) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL9927309 0.85 CYP1A2 (0.43) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL14339297 0.85 KDM4E (0.50) ALDH1A1HSD17B10HPGDCYP1A2KDM4E
SCHEMBL14339282 0.85 KDM4E (0.50) ALDH1A1HSD17B10HPGDCYP1A2KDM4E
SCHEMBL1244976 0.84 KDM4E (0.53) ALDH1A1HSD17B10HPGDCYP1A2KDM4E
SCHEMBL29380351 0.84 KDM4E (0.53) ALDH1A1HSD17B10HPGDCYP1A2KDM4E
SCHEMBL9927325 0.83 CYP1A2 (0.59) ALDH1A1HSD17B10HPGDCYP1A2THRB

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-9054319-B2 Organic electroluminescence device IDEMITSU KOSAN CO., LTD. (JP) 2015-06-09 US disclosed
US-9054319-B2 Organic electroluminescence device IDEMITSU KOSAN CO., LTD. (JP) 2015-06-09 US disclosed
US-8759819-B2 Organic electroluminescence device IDEMITSU KOSAN CO., LTD. (JP) 2014-06-24 US disclosed
US-8759819-B2 Organic electroluminescence device IDEMITSU KOSAN CO., LTD. (JP) 2014-06-24 US disclosed
US-20140131680-A1 ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2014-05-15 US disclosed
US-20140131680-A1 ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2014-05-15 US disclosed
EP-2595208-A1 LIGHT EMITTING ELEMENT Toray Industries, Inc. (JP) 2013-05-22 EP disclosed
US-20130105787-A1 LIGHT EMITTING ELEMENT TORAY INDUSTRIES, INC. (JP) 2013-05-02 US disclosed
US-20130105787-A1 LIGHT EMITTING ELEMENT TORAY INDUSTRIES, INC. (JP) 2013-05-02 US disclosed
US-20120199817-A1 ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. 2012-08-09 US disclosed
US-20120199817-A1 ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. 2012-08-09 US disclosed
US-20100283043-A1 ORGANIC EL ELEMENT IDEMITSU LOSAN CO., LTD. 2010-11-11 US disclosed
US-20100283043-A1 ORGANIC EL ELEMENT IDEMITSU LOSAN CO., LTD. 2010-11-11 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-20120199817-A1 ORGANIC ELECTROLUMINESCENCE DEVICE FTO, EML4, SLC43A1 ALDH1A1 1432/4885HSD17B10 3967/4885HPGD 4786/4885

“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.