SCHEMBL4506629

SCHEMBL4506629

Cc1ccccc1-c1cccc(C#N)c1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ADRA2C P18825 1/20 0.55
AR P10275 2/20 0.50
CLK4 Q9HAZ1 1/20 0.49
HTR7 P34969 3/20 0.47
MAOB P27338 1/20 0.47
HTR1A P08908 1/20 0.46
BRD4 O60885 1/20 0.46
GABRG2 P18507 2/20 0.44
GABRB3 P28472 2/20 0.44
GABRA5 P31644 2/20 0.44
GABRA3 P34903 2/20 0.44
PGR P06401 1/20 0.44
PDK2 Q15119 1/20 0.44
GABRA1 P14867 1/20 0.44
ADORA2A P29274 2/20 0.43
ADORA1 P30542 2/20 0.43
ADORA2B P29275 1/20 0.43
CHEK1 O14757 1/20 0.43
CREBBP Q92793 1/20 0.43

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
SCHEMBL20407070 0.91 PGR (0.49) ADRA2CARCLK4MAOBGABRG2
SCHEMBL996127 0.86 ADRA2C (0.64) ADRA2CCLK4MAOBGABRG2GABRB3
SCHEMBL21189094 0.86 ADRA2C (0.49) ADRA2CARCLK4MAOBBRD4
SCHEMBL18406713 0.85 AR (0.49) ADRA2CARHTR7HTR1A
SCHEMBL3422474 0.82 ADRA2C (0.60) ADRA2CCLK4MAOBGABRG2GABRB3
SCHEMBL31272452 0.82 ADRA2C (0.60) ADRA2CCLK4MAOBGABRG2GABRB3
SCHEMBL14850862 0.82 CLK4 (0.46) ADRA2CARCLK4MAOBBRD4
SCHEMBL20407091 0.81 PGR (0.47) ADRA2CARCLK4GABRG2GABRB3
SCHEMBL16905206 0.81 CLK4 (0.52) ADRA2CARCLK4MAOBPGR
SCHEMBL23625538 0.81 ADRA2C (0.48) ADRA2CARCLK4MAOBBRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230210000-A1 COMPOUND, LIGHT EMITTING MATERIAL, AND LIGHT EMITTING DEVICE KYULUX, INC. (JP) 2023-06-29 US disclosed
US-20200194681-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG ELECTRONICS CO LTD (KR) 2020-06-18 US disclosed
US-10615348-B2 Organic light-emitting device SAMSUNG ELECTRONICS CO., LTD. (KR) 2020-04-07 US disclosed
US-20190229276-A1 CONDENSED CYCLIC COMPOUND, COMPOSITION INCLUDING THE CONDENSED CYCLIC COMPOUND, AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING CONDENSED CYCLIC COMPOUND SAMSUNG ELECTRONICS CO., LTD. (KR) 2019-07-25 US disclosed
US-10193082-B2 Condensed-cyclic compound and organic light emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2019-01-29 US disclosed
US-10043983-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2018-08-07 US disclosed
US-10043983-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2018-08-07 US disclosed
US-20170141323-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG ELECTRONICS CO., LTD. (KR) 2017-05-18 US disclosed
US-20170054082-A1 CONDENSED-CYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2017-02-23 US disclosed
US-20170025620-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2017-01-26 US disclosed
US-20170025620-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2017-01-26 US disclosed
EP-3029026-A1 NOVEL BIPHENYL DERIVATIVE AND METHOD FOR PREPARING SAME Dong-A ST Co., Ltd. (KR) 2016-06-08 EP disclosed
US-8148535-B2 Potassium channel inhibitors MERCK SHARP & DOHME CORP. (US) 2012-04-03 US disclosed
US-20090275581-A1 RENIN INHIBITORS VITAE PHARMACEUTICALS, INC. 2009-11-05 US disclosed
US-20090233897-A1 Potassium Channel Inhibitors MERCK SHARP & DOHME CORP. 2009-09-17 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 (8 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-10043983-B2 Condensed cyclic compound and organic light-emitting device including the same CRY1, CCNE1, CRY2 ADRA2C 3380/4885AR 3051/4885CLK4 1693/4885
US-20190229276-A1 CONDENSED CYCLIC COMPOUND, COMPOSITION INCLUDING THE CONDENSED CYCLIC COMPOUND, AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING CONDENSED CYCLIC COMPOUND CRY1, CCNT1, CCND2 ADRA2C 1207/4885AR 107/4885CLK4 928/4885
US-20090275581-A1 RENIN INHIBITORS REN, ACE, SERPINB1 ADRA2C 614/4885AR 3656/4885CLK4 4398/4885
US-10193082-B2 Condensed-cyclic compound and organic light emitting device including the same CRY1, CNOT9, CNOT1 ADRA2C 1803/4885AR 456/4885CLK4 1799/4885
US-20230210000-A1 COMPOUND, LIGHT EMITTING MATERIAL, AND LIGHT EMITTING DEVICE DRD1, DRD2, DRD3 ADRA2C 559/4885AR 295/4885CLK4 571/4885
US-20170025620-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CCNE1, CRY2 ADRA2C 3380/4885AR 3051/4885CLK4 1693/4885
US-20170054082-A1 CONDENSED-CYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE INCLUDING THE SAME CRY1, CNOT9, CNOT1 ADRA2C 1803/4885AR 456/4885CLK4 1799/4885
US-20090233897-A1 Potassium Channel Inhibitors KCNJ2, KCNQ2, KCNH2 ADRA2C 717/4885AR 4159/4885CLK4 964/4885

“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.