SCHEMBL4773097

SCHEMBL4773097

O=C1NCC(c2ccc(F)cc2N2CCN(C/C=C/c3ccc(Cl)cc3)CC2)N1Cc1cnc(Cl)s1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.40
RECQL P46063 1/20 0.34
KMT2A Q03164 1/20 0.34
USP2 O75604 1/20 0.34
GRIN2B Q13224 2/20 0.33
HTR7 P34969 1/20 0.33
KDM4E B2RXH2 1/20 0.33
EBP Q15125 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL952632 0.81 LMNA (0.42) LMNARECQLKMT2AUSP2EBP
SCHEMBL952634 0.81 LMNA (0.42) LMNARECQLKMT2AUSP2EBP
SCHEMBL956190 0.73 LMNA (0.39) LMNAEBPSIGMAR1
SCHEMBL956191 0.73 LMNA (0.39) LMNAEBPSIGMAR1
SCHEMBL953297 0.71 SIGMAR1 (0.40) LMNAKMT2AUSP2KDM4EEBP
SCHEMBL953298 0.71 SIGMAR1 (0.40) LMNAKMT2AUSP2KDM4EEBP
SCHEMBL951476 0.69 SIGMAR1 (0.42) LMNAKMT2AKDM4EEBPSIGMAR1
SCHEMBL951475 0.69 SIGMAR1 (0.42) LMNAKMT2AKDM4EEBPSIGMAR1
SCHEMBL952457 0.68 LMNA (0.48) LMNAKMT2AEBPSIGMAR1ALDH1A1
SCHEMBL952455 0.68 LMNA (0.48) LMNAKMT2AEBPSIGMAR1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1755396-A1 PIPERAZIN DERIVATIVES AND THEIR USE IN CONTROLLING PESTS Syngeta Participations AG (CH) 2007-02-28 EP disclosed
WO-2005115146-A1 PIPERAZIN DERIVATIVES AND THEIR USE IN CONTROLLING PESTS SYNGENTA PARTICIPATIONS AG (CH) 2005-12-08 WO disclosed