SCHEMBL4128022

SCHEMBL4128022

Cc1cc(C)cc(-c2ccc3cc(C)ccc3n2)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 4/20 0.57
NCK1 P16333 1/20 0.53
BACE1 P56817 1/20 0.53
ESR1 P03372 1/20 0.46
ESR2 Q92731 1/20 0.46
CYP2A6 P11509 3/20 0.44
ALDH1A1 P00352 4/20 0.44
PSMB5 P28074 1/20 0.42
KDM4E B2RXH2 3/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
PDE3B Q13370 1/20 0.40
PDE3A Q14432 1/20 0.40
LMNA P02545 1/20 0.40
POLB P06746 1/20 0.40
CASP6 P55212 1/20 0.40
NQO2 P16083 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
NPC1 O15118 2/20 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
SCHEMBL13989404 0.86 CYP1A2 (0.55) CYP1A2ESR1CYP2A6ALDH1A1KDM4E
SCHEMBL29669721 0.86 CYP1A2 (0.55) CYP1A2ESR1CYP2A6ALDH1A1KDM4E
SCHEMBL10147842 0.86 CYP1A2 (0.59) CYP1A2NCK1BACE1ESR1ESR2
SCHEMBL23247265 0.86 CYP1A2 (0.68) CYP1A2NCK1BACE1ESR1ESR2
SCHEMBL13298973 0.85 CYP1A2 (0.53) CYP1A2NCK1BACE1ESR1ESR2
SCHEMBL3296780 0.85 CYP1A2 (0.53) CYP1A2NCK1BACE1ESR1ESR2
SCHEMBL13399631 0.84 BACE1 (0.49) CYP1A2NCK1BACE1ESR1ESR2
SCHEMBL12003391 0.84 BACE1 (0.49) CYP1A2NCK1BACE1ESR1ESR2
SCHEMBL14759469 0.84 NPC1 (0.59) CYP1A2NCK1BACE1ESR1ESR2
SCHEMBL29746189 0.84 NPC1 (0.59) CYP1A2NCK1BACE1ESR1ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220402877-A1 ELECTROLUMINESCENT DEVICE Beijing Summer Sprout Technology Co., Ltd. (CN) 2022-12-22 US disclosed
US-10957869-B2 Organic luminescent materials containing cycloalkyl ancillary ligands Beijing Summer Sprout Technology Co., Ltd. (CN) 2021-03-23 US disclosed
US-20190103574-A1 ORGANIC LUMINESCENT MATERIALS CONTAINING CYCLOALKYL ANCILLARY LIGANDS Beijing Summer Sprout Technology Co., Ltd. (CN) 2019-04-04 US disclosed
US-20190077818-A1 ORGANIC LUMINESCENT MATERIALS CONTAINING FLUORINE ANCILLARY LIGANDS Beijing Summer Sprout Technology Co., Ltd. (CN) 2019-03-14 US disclosed
EP-1856226-B1 RED PHOSPHORESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENCE DEVICES USING THE SAME LG ELECTRONICS INC (KR) 2014-07-23 EP disclosed
US-8071226-B2 Red phosphorescent compounds and organic electroluminescent devices using the same SFC Co. Ltd (KR) 2011-12-06 US disclosed
US-7740957-B2 Dopant iridium complexes of 2-alkylphenylquinolines and an alkanedione; dopant of the light emitting layer; host compounds are aluminum or zinc complexes; high color purity, high brightness, and long durability; flat panel displays LG ELECTRONICS INC. (KR) 2010-06-22 US disclosed
US-7740957-B2 Dopant iridium complexes of 2-alkylphenylquinolines and an alkanedione; dopant of the light emitting layer; host compounds are aluminum or zinc complexes; high color purity, high brightness, and long durability; flat panel displays LG ELECTRONICS INC. (KR) 2010-06-22 US disclosed
US-20090104472-A1 RED PHOSPHORESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICES USING THE SAME SFC CO., LTD 2009-04-23 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 (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-20190103574-A1 ORGANIC LUMINESCENT MATERIALS CONTAINING CYCLOALKYL ANCILLARY LIGANDS ACAT1, ACACA, ACAT2 CYP1A2 857/4885NCK1 1351/4885BACE1 3381/4885
US-10957869-B2 Organic luminescent materials containing cycloalkyl ancillary ligands ACAT1, ACACA, ACAT2 CYP1A2 857/4885NCK1 1351/4885BACE1 3381/4885
US-20220402877-A1 ELECTROLUMINESCENT DEVICE MCOLN2, MCOLN1, LDHB CYP1A2 2194/4885NCK1 2712/4885BACE1 2308/4885
US-20090104472-A1 RED PHOSPHORESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICES USING THE SAME TRPC1, IK, EYA2 CYP1A2 3421/4885NCK1 1033/4885BACE1 3542/4885
US-20190077818-A1 ORGANIC LUMINESCENT MATERIALS CONTAINING FLUORINE ANCILLARY LIGANDS FOXO1, NAA15, FOXK1 CYP1A2 422/4885NCK1 1307/4885BACE1 3964/4885

“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.