SCHEMBL172349

SCHEMBL172349

Cc1ccc2oc(C)c(C)c2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK9 P50750 1/20 0.53
DYRK1A Q13627 1/20 0.53
DYRK2 Q92630 1/20 0.53
MAPT P10636 4/20 0.50
ATM Q13315 1/20 0.50
ALDH2 P05091 2/20 0.48
ALDH1A2 O94788 1/20 0.48
ALDH1B1 P30837 1/20 0.48
ALDH1A3 P47895 1/20 0.48
KCNH2 Q12809 1/20 0.46
KMT2A Q03164 1/20 0.46
NPC1 O15118 4/20 0.45
HTT P42858 1/20 0.44
ALDH1A1 P00352 4/20 0.43
KDM4E B2RXH2 3/20 0.43
TP53 P04637 2/20 0.43
CYP3A4 P08684 2/20 0.43
HPGD P15428 2/20 0.43
HSD17B10 Q99714 2/20 0.43
NQO1 P15559 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
SCHEMBL12489574 0.82 ALDH2 (0.48) CDK9DYRK1ADYRK2MAPTATM
SCHEMBL1610145 0.80 MAPT (0.50) MAPTATMKCNH2KMT2ANPC1
SCHEMBL15724651 0.78 MAPT (0.47) MAPTATMKCNH2KMT2ANPC1
SCHEMBL14409919 0.78 MCL1 (0.59) CDK9DYRK1ADYRK2ALDH2ALDH1A2
SCHEMBL12301447 0.78 LMNA (0.51) CDK9DYRK1ADYRK2MAPTALDH2
SCHEMBL3894812 0.78 CDK9 (0.50) CDK9DYRK1ADYRK2MAPTALDH2
SCHEMBL12301578 0.78 CDK9 (0.50) CDK9DYRK1ADYRK2MAPTALDH2
SCHEMBL13024730 0.78 MAPT (0.47) MAPTATMNPC1HTTALDH1A1
SCHEMBL8229629 0.78 CDK9 (0.59) CDK9DYRK1ADYRK2MAPTALDH2
SCHEMBL4570872 0.78 NQO1 (0.57) MAPTALDH2ALDH1A2ALDH1B1ALDH1A3

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-20230212207-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2023-07-06 US disclosed
US-20230212207-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2023-07-06 US disclosed
US-20210155647-A1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING ORGANOMETALLIC COMPOUND, AND DIAGNOSTIC COMPOSITION INCLUDING ORGANOMETALLIC COMPOUND SAMSUNG ELECTRONICS CO., LTD. (KR) 2021-05-27 US disclosed
US-9238636-B2 Process for preparation of dronedarone by Grignard reaction SANOFI (FR) 2016-01-19 US disclosed
US-20150274688-A1 PROCESS FOR PREPARATION OF DRONEDARONE BY GRIGNARD REACTION SANOFI (FR) 2015-10-01 US disclosed
US-8202871-B2 Indol-2-one derivatives disubstituted in the 3-position, preparation thereof and therapeutic use thereof SANOFI-AVENTIS (FR) 2012-06-19 US disclosed
US-8202871-B2 Indol-2-one derivatives disubstituted in the 3-position, preparation thereof and therapeutic use thereof SANOFI-AVENTIS (FR) 2012-06-19 US disclosed
EP-2188253-B1 Indol-2-one derivatives disubstituted in 3-position, preparation thereof and therapeutic use thereof SANOFI SA (FR) 2012-03-07 EP disclosed
US-20110118280-A1 INDOL-2-ONE DERIVATIVES DISUBSTITUTED IN THE 3-POSITION, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2011-05-19 US disclosed
US-20110118280-A1 INDOL-2-ONE DERIVATIVES DISUBSTITUTED IN THE 3-POSITION, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2011-05-19 US disclosed
US-20100210662-A1 INDOL-2-ONE DERIVATIVES DISUBSTITUTED IN THE 3-POSITION, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2010-08-19 US disclosed
US-20100210662-A1 INDOL-2-ONE DERIVATIVES DISUBSTITUTED IN THE 3-POSITION, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2010-08-19 US disclosed
US-20090023747-A1 Cysteine Protease Inhibitors MEDIVIR AB (SE) 2009-01-22 US disclosed
US-7169931-B2 Cell differentiation, cell proliferation SHIONOGI & CO., LTD. (JP) 2007-01-30 US disclosed
US-7169931-B2 Cell differentiation, cell proliferation SHIONOGI & CO., LTD. (JP) 2007-01-30 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 (6 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-20100210662-A1 INDOL-2-ONE DERIVATIVES DISUBSTITUTED IN THE 3-POSITION, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF IDO2, IDO1, TPH2 CDK9 621/4885DYRK1A 177/4885DYRK2 76/4885
US-20090023747-A1 Cysteine Protease Inhibitors CTSK, CTSS, CTSZ CDK9 1240/4885DYRK1A 3482/4885DYRK2 3369/4885
US-20230212207-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD2, OTC, OCIAD1 CDK9 2845/4885DYRK1A 4681/4885DYRK2 4659/4885
US-20150274688-A1 PROCESS FOR PREPARATION OF DRONEDARONE BY GRIGNARD REACTION CYP3A4, CYP2C9, CYP4B1 CDK9 2308/4885DYRK1A 1836/4885DYRK2 1964/4885
US-20110118280-A1 INDOL-2-ONE DERIVATIVES DISUBSTITUTED IN THE 3-POSITION, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF IDO2, IDO1, TPH2 CDK9 621/4885DYRK1A 177/4885DYRK2 76/4885
US-20210155647-A1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING ORGANOMETALLIC COMPOUND, AND DIAGNOSTIC COMPOSITION INCLUDING ORGANOMETALLIC COMPOUND NOM1, MSL1, L1CAM CDK9 1749/4885DYRK1A 4573/4885DYRK2 4694/4885

“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.