SCHEMBL7733755

SCHEMBL7733755

CCCCCCCCCCCCC(Oc1ccc([N+](=O)[O-])cc1)C(=O)Cl

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 2/20 0.52
MAPT P10636 4/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
CRHBP P24387 1/20 0.48
CRHR2 Q13324 1/20 0.48
BCL9 O00512 1/20 0.47
CTNNB1 P35222 1/20 0.47
CTRC Q99895 1/20 0.44
ALDH1A1 P00352 4/20 0.43
HTR2A P28223 1/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
NPC1 O15118 1/20 0.41
HTT P42858 1/20 0.41
RAB9A P51151 1/20 0.41
PPARA Q07869 1/20 0.41
HDAC3 O15379 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC2 Q92769 1/20 0.40
LMNA P02545 1/20 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
Hydrochloric Acid SCHEMBL8101674 0.99 MGLL (0.51) MGLLMAPTL3MBTL1CRHBPCRHR2
SCHEMBL7255831 0.88 CTRC (0.56) MGLLMAPTL3MBTL1CRHBPCRHR2
SCHEMBL4832122 0.88 CTRC (0.56) MGLLMAPTL3MBTL1CRHBPCRHR2
SCHEMBL93218 0.88 CTRC (0.56) MGLLMAPTL3MBTL1CRHBPCRHR2
SCHEMBL9797409 0.86 MAPT (0.61) MGLLMAPTL3MBTL1CRHBPCRHR2
SCHEMBL9642671 0.86 MGLL (0.54) MGLLMAPTL3MBTL1CRHBPCRHR2
SCHEMBL10569376 0.84 BCL9 (0.50) MGLLMAPTL3MBTL1CRHBPCRHR2
SCHEMBL1139037 0.83 MGLL (0.51) MGLLMAPTL3MBTL1CRHBPCRHR2
SCHEMBL11576839 0.82 CTRC (0.46) L3MBTL1CTRCMEN1KMT2APPARA
SCHEMBL11576745 0.82 CTRC (0.46) L3MBTL1CTRCMEN1KMT2APPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1015479-A4 COMBINATORIAL LIBRARIES OF PEPTIDOMIMETIC MACROCYCLES AND PROCESSES THEREFOR LILLY CO ELI (US) 2002-07-24 EP disclosed
EP-1015479-A1 COMBINATORIAL LIBRARIES OF PEPTIDOMIMETIC MACROCYCLES AND PROCESSES THEREFOR ELI LILLY AND COMPANY (US) 2000-07-05 EP disclosed
US-5942387-A Combinatorial process for preparing substituted thiophene libraries ELI LILLY AND COMPANY (US) 1999-08-24 US disclosed
WO-1998057173-A1 COMBINATORIAL PROCESS FOR PREPARING SUBSTITUTED PHENYLALANINE LIBRARIES ELI LILLY AND COMPANY (US) 1998-12-17 WO disclosed
WO-1998046631-A1 COMBINATORIAL LIBRARIES OF PEPTIDOMIMETIC MACROCYCLES AND PROCESSES THEREFOR ELI LILLY AND COMPANY (US) 1998-10-22 WO disclosed
WO-1998008813-A1 COMBINATORIAL PROCESS FOR PREPARING SUBSTITUTED PYRROLIDINE LIBRARIES ELI LILLY AND COMPANY (US) 1998-03-05 WO disclosed
EP-0825164-A2 Scavenger assisted combinatorial process for preparing libraries of amides, carbamates and sulfonamides ELI LILLY AND COMPANY (US) 1998-02-25 EP disclosed
US-5166378-A Reaction of acyl chloride with azole and reacting with hydrazine salt EASTMAN KODAK COMPANY (US) 1992-11-24 US disclosed
EP-0484518-A1 SELECTIVE MONOACYLATION OF SUBSTITUTED HYDRAZINES EASTMAN KODAK COMPANY (US) 1992-05-13 EP disclosed
WO-1991017978-A2 SELECTIVE MONOACYLATION OF SUBSTITUTED HYDRAZINES EASTMAN KODAK COMPANY (US) 1991-11-28 WO disclosed
EP-0269766-B1 COLOUR PHOTOGRAPHIC ELEMENT AGFA-GEVAERT N.V. (BE) 1991-02-06 EP disclosed
US-4822729-A 2,5-Diacylaminophenol-type color couplers and photographic elements containing same AGFA-GEVAERT, N.V. (BE) 1989-04-18 US disclosed
EP-0269766-A1 Colour photographic element AGFA-GEVAERT N.V. (BE) 1988-06-08 EP disclosed