SCHEMBL732391

SCHEMBL732391

c1ccc2c(c1)-c1cccc3nccc-2c13

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
MAPK1 P28482 2/20 0.44
HSD17B10 Q99714 2/20 0.44
TSHR P16473 1/20 0.44
ATM Q13315 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
NCF1 P14598 1/20 0.40
AHR P35869 1/20 0.40
NPC1 O15118 3/20 0.40
MAPT P10636 3/20 0.40
RAB9A P51151 3/20 0.40
TP53 P04637 2/20 0.40
PTK2B Q14289 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
ESR1 P03372 1/20 0.40
CYP1A2 P05177 1/20 0.39
KDM4E B2RXH2 1/20 0.38
HPGD P15428 1/20 0.38
MEN1 O00255 1/20 0.38
APEX1 P27695 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
SCHEMBL29827450 0.88 PABPC1 (0.55) ALDH1A1MAPK1HSD17B10TSHRAHR
SCHEMBL458586 0.88 PABPC1 (0.55) ALDH1A1MAPK1HSD17B10TSHRAHR
SCHEMBL22798938 0.86 NPC1 (0.38) ALDH1A1MAPK1HSD17B10TSHRATM
SCHEMBL13854898 0.86 ALDH1A1 (0.57) ALDH1A1MAPK1HSD17B10TSHRATM
SCHEMBL17228822 0.86 MAOA (0.42) ALDH1A1MAPK1HSD17B10TSHRATM
SCHEMBL2512112 0.81 PTPRC (0.42) MAPK1SMN1; SMN2CYP1A2GSK3B
SCHEMBL22335167 0.80 PDPK1 (0.41) ALDH1A1MAPK1AHRNPC1MAPT
SCHEMBL28357765 0.79 TYMS (0.52) ALDH1A1HSD17B10NPC1MAPTRAB9A
SCHEMBL3432886 0.78 MAPK8 (0.42) ALDH1A1MAPK1HSD17B10TSHRAHR
SCHEMBL29865438 0.78 TYMS (0.35) ALDH1A1MAPK1HSD17B10L3MBTL1NCF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10629821-B2 Compound, material for organic electroluminescent elements using same, and organic electroluminescent element and electronic device each using same IDEMITSU KOSAN CO., LTD. (JP) 2020-04-21 US disclosed
US-20170237016-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS USING SAME, AND ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE EACH USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2017-08-17 US disclosed
US-20170237016-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS USING SAME, AND ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE EACH USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2017-08-17 US disclosed
US-20170148999-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD (KR) 2017-05-25 US disclosed
US-20170148999-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD (KR) 2017-05-25 US disclosed
US-9564598-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2017-02-07 US disclosed
US-9564598-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2017-02-07 US disclosed
US-20160093809-A1 ORGANIC LIGHT EMITTING DEVICE CANON KABUSHIKI KAISHA (JP) 2016-03-31 US disclosed
US-20160093809-A1 ORGANIC LIGHT EMITTING DEVICE CANON KABUSHIKI KAISHA (JP) 2016-03-31 US disclosed
US-20150318510-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD (KR) 2015-11-05 US disclosed
US-20150318510-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD (KR) 2015-11-05 US disclosed
US-9142788-B2 Host materials for OLEDs UNIVERSAL DISPLAY CORPORATION (US) 2015-09-22 US disclosed
US-9142788-B2 Host materials for OLEDs UNIVERSAL DISPLAY CORPORATION (US) 2015-09-22 US disclosed
US-8652656-B2 Triphenylene silane hosts UNIVERSAL DISPLAY CORPORATION (US) 2014-02-18 US disclosed
US-8652656-B2 Triphenylene silane hosts UNIVERSAL DISPLAY CORPORATION (US) 2014-02-18 US disclosed
US-20130119353-A1 TRIPHENYLENE SILANE HOSTS UNIVERSAL DISPLAY CORPORATION (US) 2013-05-16 US disclosed
US-20130119353-A1 TRIPHENYLENE SILANE HOSTS UNIVERSAL DISPLAY CORPORATION (US) 2013-05-16 US disclosed
US-8136974-B2 Metal coordination compound and light-emitting material containing the same NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2012-03-20 US disclosed
US-20100317858-A1 METAL COORDINATION COMPOUND AND LIGHT-EMITTING MATERIAL CONTAINING THE SAME NATIONAL INSTITUTE OF ADVANCE INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2010-12-16 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 (4 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-20130119353-A1 TRIPHENYLENE SILANE HOSTS OCIAD2, OCIAD1, YAP1 ALDH1A1 3482/4885MAPK1 3737/4885HSD17B10 2315/4885
US-20170237016-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS USING SAME, AND ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE EACH USING SAME OR10J3, LEF1, PIEZO1 ALDH1A1 1311/4885MAPK1 1684/4885HSD17B10 3062/4885
US-20100317858-A1 METAL COORDINATION COMPOUND AND LIGHT-EMITTING MATERIAL CONTAINING THE SAME CRY1, SOD1, L1CAM ALDH1A1 366/4885MAPK1 280/4885HSD17B10 3412/4885
US-10629821-B2 Compound, material for organic electroluminescent elements using same, and organic electroluminescent element and electronic device each using same OR10J3, LEF1, PIEZO1 ALDH1A1 1311/4885MAPK1 1684/4885HSD17B10 3062/4885

“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.