SCHEMBL16547005

SCHEMBL16547005

Cc1cc(C)cc(-c2cccnc2)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 7/20 0.65
CYP3A4 P08684 2/20 0.65
ALDH1A1 P00352 2/20 0.65
CYP1A2 P05177 1/20 0.65
MKNK1 Q9BUB5 2/20 0.57
MKNK2 Q9HBH9 2/20 0.57
MEN1 O00255 1/20 0.57
PSIP1 O75475 1/20 0.57
AXL P30530 1/20 0.57
GRM5 P41594 1/20 0.51
CYP19A1 P11511 2/20 0.50
KIF11 P52732 1/20 0.50
DYRK1A Q13627 1/20 0.50
DYRK1B Q9Y463 1/20 0.50
KDM4E B2RXH2 1/20 0.50
LMNA P02545 1/20 0.50
TP53 P04637 1/20 0.50
MAPT P10636 1/20 0.50
HPGD P15428 1/20 0.50
ALOX15 P16050 1/20 0.50

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
SCHEMBL27430951 0.96 CYP2A6 (0.60) CYP2A6CYP3A4ALDH1A1CYP1A2MKNK1
SCHEMBL12070458 0.96 CYP2A6 (0.65) CYP2A6CYP3A4ALDH1A1CYP1A2MKNK1
SCHEMBL10262832 0.96 CYP2A6 (0.65) CYP2A6CYP3A4ALDH1A1CYP1A2MKNK1
SCHEMBL12131368 0.92 CYP2A6 (0.60) CYP2A6CYP3A4ALDH1A1CYP1A2MKNK1
SCHEMBL22693745 0.92 CYP2A6 (0.60) CYP2A6CYP3A4ALDH1A1CYP1A2MKNK1
SCHEMBL10263457 0.90 CYP19A1 (0.59) CYP2A6CYP3A4ALDH1A1CYP1A2MKNK1
SCHEMBL19309598 0.88 NPY5R (0.56) CYP2A6CYP3A4ALDH1A1CYP1A2MKNK1
SCHEMBL19309597 0.88 CYP2A6 (0.56) CYP2A6CYP3A4ALDH1A1CYP1A2MKNK1
SCHEMBL13624039 0.88 CYP2A6 (0.56) CYP2A6CYP3A4ALDH1A1CYP1A2MKNK1
SCHEMBL11996125 0.88 CYP2A6 (0.56) CYP2A6CYP3A4ALDH1A1CYP1A2MKNK1

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230363260-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2023-11-09 US disclosed
US-11730053-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2023-08-15 US disclosed
US-20220165365-A1 COMPLEX ARCHITECTURE FOR REACTION CONDITION DETERMINATION THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS 2022-05-26 US disclosed
US-11050027-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2021-06-29 US disclosed
US-10040794-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2018-08-07 US disclosed
US-10038147-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2018-07-31 US disclosed
US-10032985-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2018-07-24 US disclosed
US-10032985-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2018-07-24 US disclosed
US-10026906-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2018-07-17 US disclosed
CN-105294776-B A kind of preparation method of the symmetrical dimer of nitrogen heterocyclic ring aromatic compound 兰州大学 2018-06-15 CN disclosed
US-9768393-B2 Condensed-cyclic compound and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2017-09-19 US disclosed
US-20170213987-A1 CARBAZOLE-BASED COMPOUND AND ORGANIC LIGHT EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2017-07-27 US disclosed
CN-105294776-A Method for preparing symmetric dimer of nitrogen heterocyclic ring aromatic compound UNIV LANZHOU 2016-02-03 CN disclosed
US-20150144924-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG SDI CO., LTD. (KR) 2015-05-28 US disclosed
US-20150090968-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2015-04-02 US disclosed
US-20150060791-A1 CONDENSED-CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2015-03-05 US disclosed
CN-101835745-B Method for producing disulfonic acid compound, asymmetric mannich catalyst, method for producing beta-aminocarbonyl derivative, and disulfonate salt UNIV NAGOYA NAT UNIV CORP 2013-08-28 CN disclosed
CN-101835745-A Method for producing disulfonic acid compound, asymmetric mannich catalyst, method for producing beta-aminocarbonyl derivative, and novel disulfonate UNIV NAGOYA NAT UNIV CORP 2010-09-15 CN disclosed
CN-1291976-C Antiretroviral pyridine and quinoline derivatives UNIROYAL CHEM CO INC (US) 2006-12-27 CN disclosed
CN-1592741-A Antiretroviral pyridine and quinoline derivatives UNIROYAL CHEM CO INC (US) 2005-03-09 CN 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 (5 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-11050027-B2 Condensed cyclic compound and organic light-emitting device including the same CCNT1, CRY1, CCNA1 CYP2A6 1388/4885CYP3A4 1728/4885ALDH1A1 1017/4885
US-20170213987-A1 CARBAZOLE-BASED COMPOUND AND ORGANIC LIGHT EMITTING DEVICE INCLUDING THE SAME CRY1, CYP1A1, COX6B1 CYP2A6 22/4885CYP3A4 8/4885ALDH1A1 137/4885
US-10026906-B2 Condensed cyclic compound and organic light-emitting device including the same CRY1, CCNL2, CRY2 CYP2A6 3171/4885CYP3A4 1186/4885ALDH1A1 173/4885
US-10032985-B2 Condensed cyclic compound and organic light-emitting device including the same CCNT1, CCNA1, CRY1 CYP2A6 1441/4885CYP3A4 1446/4885ALDH1A1 1164/4885
US-10040794-B2 Condensed cyclic compound and organic light-emitting device including the same CRY1, CCNE2, CRY2 CYP2A6 1326/4885CYP3A4 497/4885ALDH1A1 352/4885

“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.