SCHEMBL5536641

SCHEMBL5536641

Nc1cccc2c1=NC(N)(c1ccccc1)N=2

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 3/20 0.33
BACE2 Q9Y5Z0 2/20 0.33
CYP3A4 P08684 1/20 0.31
ALOX15 P16050 1/20 0.31
CASP1 P29466 1/20 0.31
CASP7 P55210 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
REN P00797 1/20 0.30
APP P05067 1/20 0.30
KDM4E B2RXH2 1/20 0.30
NPC1 O15118 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
GLA P06280 1/20 0.30
POLB P06746 1/20 0.30
GAA P10253 1/20 0.30
HPGD P15428 1/20 0.30
PTBP1 P26599 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL10446169 0.69 CD44 (0.37) CYP3A4ALOX15CASP1CASP7SMN1; SMN2
SCHEMBL5607855 0.68 BACE1 (0.33) BACE1BACE2CYP3A4ALOX15CASP1
SCHEMBL7551055 0.61 PNMT (0.39)
SCHEMBL2224688 0.59 BACE1 (0.34) BACE1BACE2RENAPP
Hydrochloric Acid SCHEMBL14576582 0.58 BACE1 (0.33) BACE1BACE2RENAPP
Hydrochloric Acid SCHEMBL21192543 0.58 BACE1 (0.33) BACE1BACE2RENAPP
SCHEMBL9718903 0.58 BACE1 (0.41) BACE1BACE2RENAPPLMNA
SCHEMBL11264366 0.58 LMNA (0.38) BACE1BACE2RENAPPKDM4E
SCHEMBL4266501 0.58 MAOA (0.33) BACE1BACE2RENAPP
SCHEMBL22003326 0.57 CYP3A4 (0.91) CYP3A4ALOX15CASP1CASP7SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5646234-A AROMATIC POLYAMIDES HOECHST AG (DE) 1997-07-08 US claimed
EP-0695776-A2 Process for the preparation of fibers or films, and fibers or films obtained therefrom HOECHST AKTIENGESELLSCHAFT (DE) 1996-02-07 EP claimed
WO-2007094561-A1 HIGH MOLOCULAR ELECTROLYTE MEMBRANE FOR FUEL CELL, AND MEMBRANE-ELECTRODE ASSEMBLY THEREBY, FUEL CELL CHEIL INDUSTRIES INC. (KR) 2007-08-23 WO disclosed
EP-0718425-B1 Two-component intermingled sewing threads from aramid filaments, their production process and their use HOECHST TREVIRA GMBH & CO KG (DE) 1999-06-09 EP disclosed
US-5646234-A AROMATIC POLYAMIDES HOECHST AG (DE) 1997-07-08 US disclosed
US-5645935-A Two-component loop yarns comprising aramid filaments, manufacture thereof and use thereof HOECHST TREVIRA GMBH & CO. KG (DE) 1997-07-08 US disclosed
US-5571891-A FROM 2-AMINOPHENYL-SUBSTITUTED AMINOBENZIMIDAZOLES, AMINOBENZOTHIAZOLES OR AMINOBENZOXAZOLES HOECHST AKTIENGESELLSCHAFT (DE) 1996-11-05 US disclosed
EP-0718425-A1 Two-component intermingled sewing threads from aramid filaments, their production process and their use Hoechst Trevira GmbH & Co. KG (DE) 1996-06-26 EP disclosed
EP-0695776-A2 Process for the preparation of fibers or films, and fibers or films obtained therefrom HOECHST AKTIENGESELLSCHAFT (DE) 1996-02-07 EP disclosed
EP-0678539-A2 Aromatic copolyamides, process for their preparation, moulded articles and their manufacture HOECHST AKTIENGESELLSCHAFT (DE) 1995-10-25 EP disclosed