SCHEMBL13129261

SCHEMBL13129261

c1cc(-c2ccc3c4ccccc4c4ccccc4c3c2)c2sccc2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.41
CYP2A6 P11509 1/20 0.39
ATR Q13535 1/20 0.36
MCL1 Q07820 1/20 0.35
ACMSD Q8TDX5 1/20 0.35
SCN9A Q15858 1/20 0.34
HPRT1 P00492 3/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
CASP1 P29466 1/20 0.33
HIF1A Q16665 1/20 0.33
HSD17B10 Q99714 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
PRKDC P78527 1/20 0.33
GSK3A P49840 1/20 0.33
GSK3B P49841 1/20 0.33
CYP1A1 P04798 2/20 0.33
CYP1B1 Q16678 2/20 0.33

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
SCHEMBL14603448 0.80 ALOX5 (0.59) ALOX5ALDH1A1HPGDPRKDC
SCHEMBL12938612 0.79 CYP2A6 (0.43) ALOX5CYP2A6ATRSCN9AHDAC4
SCHEMBL19756685 0.78 ATR (0.46) CYP2A6ATRALDH1A1HPGDTSHR
SCHEMBL27517016 0.78 CYP2A6 (0.48) CYP2A6ATRSCN9AALDH1A1TSHR
SCHEMBL28846883 0.77 RORC (0.44) CYP2A6ATRALDH1A1TSHRHSD17B10
SCHEMBL10018852 0.77 ALOX5 (0.54) ALOX5MCL1ACMSDHPRT1ALDH1A1
SCHEMBL15893274 0.76 ALOX5 (0.51) ALOX5MCL1ACMSDPRKDCCYP1A1
SCHEMBL22891179 0.76 ALOX5 (0.55) ALOX5CYP2A6ATRALDH1A1HPGD
SCHEMBL20124391 0.76 MCL1 (0.53) MCL1ACMSDHPRT1HDAC8TLR8
SCHEMBL25118639 0.75 ALOX5 (0.47) ALOX5CYP2A6MCL1ACMSDHPRT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10374171-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2019-08-06 US disclosed
US-9997727-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2018-06-12 US disclosed
US-9997727-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2018-06-12 US disclosed
US-9705092-B2 Phosphorescent organic light emitting devices combined with hole transport material having high operating stability UNIVERSAL DISPLAY CORPORATION (US) 2017-07-11 US disclosed
US-9705092-B2 Phosphorescent organic light emitting devices combined with hole transport material having high operating stability UNIVERSAL DISPLAY CORPORATION (US) 2017-07-11 US disclosed
US-20170117489-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2017-04-27 US disclosed
US-20170117489-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2017-04-27 US disclosed
US-9577200-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2017-02-21 US disclosed
US-9577200-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2017-02-21 US disclosed
US-20150372243-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2015-12-24 US disclosed
US-9153786-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2015-10-06 US disclosed
US-20140339518-A1 PHOSPHORESCENT ORGANIC LIGHT EMITTING DEVICES COMBINED WITH HOLE TRANSPORT MATERIAL HAVING HIGH OPERATING STABILITY HODOGAYA CHEMICAL CO., LTD. (JP) 2014-11-20 US disclosed
US-20140326977-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION 2014-11-06 US disclosed
US-8822708-B2 Benzo-fused thiophene / triphenylene hybrid materials UNIVERSAL DISPLAY CORPORATION (US) 2014-09-02 US disclosed
US-20130175510-A1 BENZO-FUSED THIOPHENE / TRIPHENYLENE HYBRID MATERIALS UNIVERSAL DISPLAY CORPORTION (US) 2013-07-11 US disclosed
US-8367850-B2 Benzo-fused thiophene or benzo-fused furan compounds comprising a triphenylene group UNIVERSAL DISPLAY CORPORATION (US) 2013-02-05 US disclosed
US-20100237334-A1 Benzo-Fused Thiophene or Bezon-Fused Furan Compounds Comprising a Triphenylene Group UNIVERSAL DISPLAY CORPORATION (US) 2010-09-23 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-20100237334-A1 Benzo-Fused Thiophene or Bezon-Fused Furan Compounds Comprising a Triphenylene Group TFEB, BRD4, TEC ALOX5 1734/4885CYP2A6 1199/4885ATR 385/4885
US-20170117489-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES TPR, EED, TEC ALOX5 2467/4885CYP2A6 3927/4885ATR 975/4885
US-20150372243-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES TPR, EED, TEAD2 ALOX5 1768/4885CYP2A6 4008/4885ATR 1818/4885
US-10374171-B2 Organic electroluminescent materials and devices TPR, EED, TEAD2 ALOX5 1768/4885CYP2A6 4008/4885ATR 1818/4885

“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.