SCHEMBL564343

SCHEMBL564343

Cc1ccc2c(N)c(C)ccc2n1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.51
KDM4E B2RXH2 6/20 0.47
LMNA P02545 4/20 0.47
GAA P10253 4/20 0.47
HPGD P15428 4/20 0.47
MAPT P10636 3/20 0.47
POLB P06746 3/20 0.47
HSD17B10 Q99714 3/20 0.47
CASP6 P55212 1/20 0.47
KMT2A Q03164 4/20 0.41
MEN1 O00255 1/20 0.41
NCF1 P14598 1/20 0.41
OPRK1 P41145 1/20 0.41
CYP1A2 P05177 4/20 0.41
SMN1; SMN2 Q16637 4/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C19 P33261 1/20 0.41
GLA P06280 2/20 0.40
CASP1 P29466 2/20 0.40
CASP7 P55210 2/20 0.40

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
SCHEMBL7455519 0.83 KDM4E (0.47) ALDH1A1KDM4ELMNAGAAHPGD
SCHEMBL564237 0.80 KDM4E (0.44) ALDH1A1KDM4ELMNAGAAHPGD
SCHEMBL564769 0.80 LMNA (0.46) ALDH1A1KDM4ELMNAGAAHPGD
SCHEMBL3844688 0.80 KDM4E (0.44) ALDH1A1KDM4ELMNAGAAHPGD
SCHEMBL8571925 0.79 ALDH1A1 (0.53) ALDH1A1KDM4ELMNAGAAPOLB
SCHEMBL6518079 0.79 KDM4E (0.47) ALDH1A1KDM4ELMNAGAAPOLB
Hydrochloric Acid SCHEMBL4504877 0.79 KDM4E (0.43) ALDH1A1KDM4ELMNAGAAHPGD
SCHEMBL21787707 0.79 KDM4E (0.43) ALDH1A1KDM4ELMNAGAAHPGD
SCHEMBL2851573 0.78 NCF1 (0.37) ALDH1A1KDM4ELMNAGAAHPGD
SCHEMBL862762 0.78 ALDH1A1 (0.55) ALDH1A1KDM4ELMNAMAPTPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140200354-A1 Process for the Manufacture of Non-Steroidal Anti-Inflammatory Agents and Intermediates Thereof INTENDIS GMBH (DE) 2014-07-17 US claimed
US-8372865-B2 Dihydropyridone amides as P2X7 modulators ROCHE PALO ALTO LLC (US) 2013-02-12 US claimed
US-20120035371-A1 PROCESS FOR THE MANUFACTURE OF NON-STEROIDAL ANTI-INFLAMMATORY AGENTS AND INTERMEDIATES THEREOF SCHWEIZER STEFFEN (DE) 2012-02-09 US claimed
US-8071796-B2 Process for the manufacture of non-steroidal anti-inflammatory agents and intermediates thereof INTENDIS GMBH (DE) 2011-12-06 US claimed
CN-101679247-A Process for preparing non-steroidal anti-inflammatory drugs and intermediates thereof INTENDIS GMBH 2010-03-24 CN claimed
US-20080274517-A1 PROCESS FOR THE MANUFACTURE OF NON-STEROIDAL ANTI-INFLAMMATORY AGENTS AND INTERMEDIATES THEREOF INTENDIS GMBH (DE) 2008-11-06 US claimed
EP-1982976-A1 Process for the manufacture of non-steroidal anti-inflammatory agents and intermediates thereof Intendis GmbH (DE) 2008-10-22 EP claimed
WO-2020012865-A1 QUINOPHTHALONE COMPOUND DIC株式会社 2020-01-16 WO disclosed
US-20140200354-A1 Process for the Manufacture of Non-Steroidal Anti-Inflammatory Agents and Intermediates Thereof INTENDIS GMBH (DE) 2014-07-17 US disclosed
CN-101679247-B Process for preparing non-steroidal anti-inflammatory drugs and intermediates thereof INTENDIS GMBH 2014-02-19 CN disclosed
US-8435990-B2 Dihydropyrimidone amides as P2X7 modulators ROCHE PALO ALTO LLC (US) 2013-05-07 US disclosed
US-8435990-B2 Dihydropyrimidone amides as P2X7 modulators ROCHE PALO ALTO LLC (US) 2013-05-07 US disclosed
US-8435990-B2 Dihydropyrimidone amides as P2X7 modulators ROCHE PALO ALTO LLC (US) 2013-05-07 US disclosed
US-20060116396-A1 5-Substituted quinoline and isoquinoline derivatives, a process for their production and their use as anti-inflammatory agents BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2006-06-01 US disclosed
WO-2006050998-A1 5-SUBSTITUTED QUINOLINE AND ISOQUINOLINE DERIVATIVES, A METHOD FOR THE PRODUCTION THEREOF AND THEIR USE AS ANTIPHLOGISTICS BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2006-05-18 WO disclosed
US-20050165050-A1 Quinoline and isoquinoline derivatives, a process for their production and their use as inflammation inhibitors BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2005-07-28 US disclosed
US-6897224-B2 Quinoline and isoquinoline derivatives, a process for their production and their use as inflammation inhibitors SCHERING AG (DE) 2005-05-24 US disclosed
EP-1492771-A1 QUINOLINE AND ISOQUINOLINE DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF AND USE THEREOF AS ANTI-INFLAMMATORY AGENTS SCHERING AKTIENGESELLSCHAFT (DE) 2005-01-05 EP disclosed
US-20040116694-A1 Quinoline and isoquinoline derivatives, a process for their production and their use as inflammation inhibitors SCHERING AG (DE) 2004-06-17 US disclosed
WO-2003082827-A1 QUINOLINE AND ISOQUINOLINE DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF AND USE THEREOF AS ANTI-INFLAMMATORY AGENTS SCHERING AKTIENGESELLSCHAFT (DE) 2003-10-09 WO 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-20060116396-A1 5-Substituted quinoline and isoquinoline derivatives, a process for their production and their use as anti-inflammatory agents NFKBIA, PTGS2, PTGES2 ALDH1A1 760/4885KDM4E 3270/4885LMNA 3196/4885
US-20080274517-A1 PROCESS FOR THE MANUFACTURE OF NON-STEROIDAL ANTI-INFLAMMATORY AGENTS AND INTERMEDIATES THEREOF CYP2F1, CYP4A11, CYP11B1 ALDH1A1 1684/4885KDM4E 1779/4885LMNA 3079/4885
US-20120035371-A1 PROCESS FOR THE MANUFACTURE OF NON-STEROIDAL ANTI-INFLAMMATORY AGENTS AND INTERMEDIATES THEREOF CYP2F1, CYP4A11, CYP11B1 ALDH1A1 1684/4885KDM4E 1779/4885LMNA 3079/4885
US-20050165050-A1 Quinoline and isoquinoline derivatives, a process for their production and their use as inflammation inhibitors NFKBIA, IL1B, IRF3 ALDH1A1 1538/4885KDM4E 3072/4885LMNA 3290/4885
US-20140200354-A1 Process for the Manufacture of Non-Steroidal Anti-Inflammatory Agents and Intermediates Thereof CYP2F1, CYP4A11, CYP11B1 ALDH1A1 1720/4885KDM4E 1742/4885LMNA 3066/4885

“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.