SCHEMBL8523679

SCHEMBL8523679

Nc1nc(NCCN2CCOCC2)nc(C2CCCC(c3nc(N)nc(NCCN4CCOCC4)n3)C2)n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
LMNA P02545 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HTT P42858 1/20 0.41
TSHR P16473 1/20 0.41
BACE1 P56817 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
RAB9A P51151 1/20 0.39
CDK1 P06493 1/20 0.39
CDK2 P24941 1/20 0.39
PIK3CA P42336 5/20 0.39
MTOR P42345 5/20 0.39
HTR1A P08908 1/20 0.38
DRD2 P14416 1/20 0.38
HTR2A P28223 1/20 0.38
HTR7 P34969 1/20 0.38
HTR6 P50406 1/20 0.38
EGFR P00533 1/20 0.38

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
SCHEMBL8468597 0.89 MEN1 (0.47) MEN1KMT2ALMNAKDM4EALDH1A1
SCHEMBL8467788 0.82 MEN1 (0.53) MEN1KMT2ALMNAKDM4EALDH1A1
SCHEMBL8853156 0.82 MEN1 (0.45) MEN1KMT2ALMNAKDM4EALDH1A1
SCHEMBL8466273 0.81 MEN1 (0.44) MEN1KMT2ALMNAKDM4EALDH1A1
SCHEMBL8853168 0.81 MEN1 (0.57) MEN1KMT2ALMNAKDM4EALDH1A1
SCHEMBL8713795 0.80 MEN1 (0.38) MEN1KMT2ALMNAKDM4EALDH1A1
SCHEMBL8853402 0.79 MEN1 (0.46) MEN1KMT2ALMNAKDM4EALDH1A1
SCHEMBL8467230 0.77 MEN1 (0.56) MEN1KMT2ALMNAKDM4EALDH1A1
SCHEMBL8853170 0.76 CA1 (0.46) MEN1KMT2ALMNAALDH1A1TSHR
SCHEMBL8468651 0.76 SLC29A1 (0.38) MEN1KMT2ACDK1CDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5869184-A RESIN RAW MATERIALS FOR PAINTS, ADHESIVES MITSUI TOATSU CHEMICALS, INC. (JP) 1999-02-09 US disclosed
US-5744504-A AMINO RESIN; THERMOSETTING MOLDING MATERIALS MITSUI TOATSU CHEMICALS, INC. (JP) 1998-04-28 US disclosed
US-5648446-A ADHESIVES, FIREPROOFING, HEAT RESISTANCE IN RESINS FOR MOLDING MATERIALS MITSUI TOATSU CHEMICALS, INC. (JP) 1997-07-15 US disclosed
US-5646240-A THERMOSETTING MOLDING COMPOSITIONS MITSUI TOATSU CHEMICALS, INC. (JP) 1997-07-08 US disclosed
US-5596039-A FLAME RETARDERS, HEAT RESISTANCE MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1997-01-21 US disclosed
US-5569726-A USEFUL IN FLAME-RETARDING, THERMAL STABILIZATION AND COMPATIBILIZATION OF RESINS AND IN THERMOSETTING MOLDING COMPOSITIONS MITSUI TOATSU CHEMICALS, INC. (JP) 1996-10-29 US disclosed
US-5545702-A THERMOSETTING RESIN COMPOSITION MITSUI TOATSU CHEMICALS, INC. (JP) 1996-08-13 US disclosed
US-5536795-A ADHESIVES AND PAINTS AND FIREPROOFING THERMOSETTING RESINS MITSUI TOATSU CHEMICALS, INC. (JP) 1996-07-16 US disclosed
US-5480947-A N-METHYLOL DIGUANAMINES MITSUI TOATSU CHEMICALS, INC. (JP) 1996-01-02 US disclosed
EP-0612777-A2 Thermosetting molding and expansion-forming compositions MITSUI TOATSU CHEMICALS, Inc. (JP) 1994-08-31 EP disclosed
EP-0612797-A2 Modification method of resins MITSUI TOATSU CHEMICALS, Inc. (JP) 1994-08-31 EP disclosed