SCHEMBL1006730

SCHEMBL1006730

Cc1cc(C(=O)N(C)C)cc(C)c1N

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ TDP1 Q9NUW8 2/20 0.42
▸ TP53 P04637 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ HPGD P15428 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ POLB P06746 2/20 0.37
▸ MAP4K1 Q92918 1/20 0.37
▸ HSD11B1 P28845 1/20 0.35
▸ KIF11 P52732 2/20 0.35
▸ MITF O75030 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ ERN1 O75460 1/20 0.34
▸ CYP19A1 P11511 1/20 0.33
▸ HSP90AA1 P07900 1/20 0.33
▸ PDK2 Q15119 1/20 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
SCHEMBL13681549 0.82 SMN1; SMN2 (0.43) MAPTALDH1A1HPGDSMN1; SMN2NPC1
SCHEMBL15262520 0.78 HPGD (0.41) MAPTALDH1A1CYP3A4HPGDSMN1; SMN2
SCHEMBL18615158 0.78 ALDH1A1 (0.41) MAPTALDH1A1TSHRHPGDSMN1; SMN2
SCHEMBL1004232 0.78 HPGD (0.41) ALDH1A1HPGDSMN1; SMN2NPC1POLB
SCHEMBL12221612 0.78 SMN1; SMN2 (0.52) MAPTALDH1A1HPGDSMN1; SMN2ERN1
SCHEMBL384544 0.78 MAPT (0.46) MAPTALDH1A1TDP1CYP3A4TSHR
SCHEMBL24041391 0.77 ALDH1A1 (0.43) MAPTALDH1A1HPGDSMN1; SMN2KDM4E
SCHEMBL583560 0.77 ALDH1A1 (0.43) MAPTALDH1A1HPGDSMN1; SMN2KDM4E
SCHEMBL9808238 0.77 HSD11B1 (0.55) MAPTALDH1A1CYP3A4HPGDSMN1; SMN2
SCHEMBL13681507 0.77 TLR8 (0.43) ALDH1A1HPGDSMN1; SMN2NPC1ERN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3810608-B1 OGA INHIBITOR COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2022-08-10 — — EP disclosed
US-20210277003-A1 OGA INHIBITOR COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2021-09-09 — — US disclosed
EP-3573959-B1 BENZYLAMINOPYRAZINYLCYCLOPROPANECARBOXYLIC ACIDS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF BOEHRINGER INGELHEIM INT (DE) 2021-07-28 — — EP disclosed
US-20210130352-A1 OGA INHIBITOR COMPOUNDS JANSSEN-CILAG S.A. (ES) 2021-05-06 — — US disclosed
EP-3544958-B1 INDANYLAMINOPYRIDYLCYCLOPROPANECARBOXYLIC ACIDS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF BOEHRINGER INGELHEIM INT (DE) 2021-03-24 — — EP disclosed
EP-3532458-B1 BENZYLAMINOPYRIDYLCYCLOPROPANECARBOXYLIC ACIDS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF BOEHRINGER INGELHEIM INT (DE) 2021-01-20 — — EP disclosed
WO-2019243533-A1 OGA INHIBITOR COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2019-12-26 — — WO disclosed
WO-2019243535-A1 OGA INHIBITOR COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2019-12-26 — — WO disclosed
EP-3331860-B1 INDANYLAMINOPYRIDYLCYCLOPROPANECARBOXYLIC ACIDS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF BOEHRINGER INGELHEIM INT (DE) 2019-07-17 — — EP disclosed
WO-2018138026-A1 INDANYLAMINOPYRAZINYLCYCLOPROPANECARBOXYLIC ACIDS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2018-08-02 — — WO disclosed
US-20130338389-A1 IONIC LIQUIDS FOR SEPARATION OF OLEFIN-PARAFFIN MIXTURES UT-BATTELLE, LLC (US) 2013-12-19 — — US disclosed
WO-2013144097-A1 NEW INDANYLOXYDIHYDROBENZOFURANYLACETIC ACID DERIVATIVES AND THEIR USE AS GPR40 RECEPTOR AGONISTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-10-03 — — WO disclosed
WO-2013144097-A1 NEW INDANYLOXYDIHYDROBENZOFURANYLACETIC ACID DERIVATIVES AND THEIR USE AS GPR40 RECEPTOR AGONISTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-10-03 — — WO disclosed
WO-2013144098-A1 NEW INDANYLOXYDIHYDROBENZOFURANYLACETIC ACID DERIVATIVES AND THEIR USE AS GPR40 RECEPTOR AGONISTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-10-03 — — WO disclosed
WO-2013144098-A1 NEW INDANYLOXYDIHYDROBENZOFURANYLACETIC ACID DERIVATIVES AND THEIR USE AS GPR40 RECEPTOR AGONISTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-10-03 — — WO disclosed
US-20130252937-A1 NEW INDANYLOXYDIHYDROBENZOFURANYLACETIC ACIDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-09-26 — — US disclosed
US-20130252937-A1 NEW INDANYLOXYDIHYDROBENZOFURANYLACETIC ACIDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-09-26 — — US disclosed
US-20130252937-A1 NEW INDANYLOXYDIHYDROBENZOFURANYLACETIC ACIDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-09-26 — — US disclosed
US-8535560-B2 Ionic liquids for separation of olefin-paraffin mixtures UT-BATTELLE, LLC (US) 2013-09-17 — — US disclosed
US-20110015461-A1 Ionic Liquids for Separation of Olefin-Paraffin Mixtures UT-BATTELLE, LLC (US) 2011-01-20 — — 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-20130338389-A1 IONIC LIQUIDS FOR SEPARATION OF OLEFIN-PARAFFIN MIXTURES POU2F1, POU2F2, POF1B MAPT 3226/4885ALDH1A1 1816/4885TDP1 3541/4885
US-20210277003-A1 OGA INHIBITOR COMPOUNDS OGA, OGT, GRN MAPT 7/4885ALDH1A1 3839/4885TDP1 83/4885
US-20130252937-A1 NEW INDANYLOXYDIHYDROBENZOFURANYLACETIC ACIDS GPR119, GPR55, GPR52 MAPT 4256/4885ALDH1A1 216/4885TDP1 4402/4885
US-20210130352-A1 OGA INHIBITOR COMPOUNDS OGA, OGT, GRN MAPT 7/4885ALDH1A1 3839/4885TDP1 83/4885
US-20110015461-A1 Ionic Liquids for Separation of Olefin-Paraffin Mixtures POU2F1, POU2F2, POF1B MAPT 3226/4885ALDH1A1 1816/4885TDP1 3541/4885

“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.

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