SCHEMBL6319347

SCHEMBL6319347

CC(=O)N(CCN(C)C)c1ccc(N/C(=C2\C(=O)Nc3ccccc32)c2ccccc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
KMT2A Q03164 1/20 0.39
IDO1 P14902 2/20 0.38
TDO2 P48775 1/20 0.38
KDR P35968 1/20 0.37
POLB P06746 1/20 0.35
ALDH1A1 P00352 4/20 0.35
HPGD P15428 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
MST1R Q04912 1/20 0.35
MAPT P10636 4/20 0.33
TP53 P04637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
LMNA P02545 1/20 0.33
TGM2 P21980 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL6319359 1.00 MEN1 (0.39) MEN1NPC1RAB9AKMT2AIDO1
SCHEMBL6319632 0.94 MEN1 (0.38) MEN1NPC1RAB9AKMT2AIDO1
SCHEMBL6319638 0.94 MEN1 (0.38) MEN1NPC1RAB9AKMT2AIDO1
SCHEMBL6319734 0.92 ALDH1A1 (0.39) MEN1NPC1RAB9AKMT2AIDO1
SCHEMBL6319743 0.92 ALDH1A1 (0.39) MEN1NPC1RAB9AKMT2AIDO1
SCHEMBL6328091 0.90 IDO1 (0.41) MEN1NPC1RAB9AKMT2AIDO1
SCHEMBL6328087 0.90 IDO1 (0.41) MEN1NPC1RAB9AKMT2AIDO1
SCHEMBL4493761 0.90 CCNB2 (0.35) POLBALDH1A1HPGDMST1RLMNA
SCHEMBL4493758 0.90 CCNB2 (0.35) POLBALDH1A1HPGDMST1RLMNA
SCHEMBL30979372 0.90 CCNB2 (0.35) POLBALDH1A1HPGDMST1RLMNA

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
EP-0973855-B1 BLEACH COMPOSITIONS CONTAINING METAL BLEACH CATALYST, AND BLEACH ACTIVATORS AND/OR ORGANIC PERCARBOXYLIC ACIDS PROCTER & GAMBLE (US) 2003-08-06 EP claimed
EP-1322739-B1 GRANULATED COMPOSITION GIVAUDAN SA (CH) 2005-11-30 EP disclosed
US-20050250667-A1 Effervescent granulated composition GIVAUDAN SA (CH) 2005-11-10 US disclosed
US-6855710-B2 Substituted indolines with an inhibitory effect on various kinases and complexes of CDKs BOEHRINGER INGELHEIM PHARMA KG (DE) 2005-02-15 US disclosed
EP-1470210-A1 EFFERVESCENT GRANULATED COMPOSITION Givaudan SA (CH) 2004-10-27 EP disclosed
US-20040115231-A1 Granulated composition HART GERALD LESLIE (GB) 2004-06-17 US disclosed
US-20040058978-A1 Novel substituted indolines with an inhibitory effect on various kinases and complexes of CDKs BOEHRINGER INGELHEIM PHARMA KG (DE) 2004-03-25 US disclosed
WO-2003064579-A1 EFFERVESCENT GRANULATED COMPOSITION GIVAUDAN SA (CH) 2003-08-07 WO disclosed
US-6602441-B1 Activators for peroxy compounds in laundry detergents and cleaning products CLARIANT GMBH (DE) 2003-08-05 US disclosed
EP-1322739-A2 GRANULATED COMPOSITION Givaudan SA (CH) 2003-07-02 EP disclosed
EP-1115704-B1 NOVEL SUBSTITUTED INDOLINONES WITH AN INHIBITORY EFFECT ON VARIOUS KINASES AND CYCLIN/CDK COMPLEXES BOEHRINGER INGELHEIM PHARMA (DE) 2003-06-18 EP disclosed
WO-2002024847-A2 GRANULATED COMPOSITION GIVAUDAN SA (CH) 2002-03-28 WO disclosed
US-6139769-A CONTACTING A SUBSTRATE WITH AN AQUEOUS SOLUTION COMPRISING A PEROXIDE AND A METAL COMPLEX BLEACH ACTIVATOR FOR LAUNDERING AND CLEANING CLARIANT GMBH (DE) 2000-10-31 US disclosed
US-5998645-A LAUNDERING DETERGENTS; CLEANING COMPOUNDS CLARIANT GMBH (DE) 1999-12-07 US disclosed
US-5969171-A Metal complexes as bleach activators CLARIANT GMBH (DE) 1999-10-19 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 (1 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-20040058978-A1 Novel substituted indolines with an inhibitory effect on various kinases and complexes of CDKs CDK1, CDK2, CDK3 MEN1 3345/4885NPC1 4477/4885RAB9A 2092/4885

“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.