SCHEMBL25802484

SCHEMBL25802484

Clc1ccc(N2c3ccccc3Nc3ccccc32)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
ELANE P08246 2/20 0.41
MGLL Q99685 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
GAA P10253 1/20 0.40
ITGA4 P13612 1/20 0.40
ITGB7 P26010 1/20 0.40
ALDH1A1 P00352 3/20 0.38
PGR P06401 2/20 0.38
LMNA P02545 1/20 0.38
BCHE P06276 2/20 0.38
ACHE P22303 2/20 0.38
NOX1 Q9Y5S8 1/20 0.38
KDM4E B2RXH2 2/20 0.37
HPGD P15428 2/20 0.37
CASP1 P29466 2/20 0.37
CASP7 P55210 2/20 0.37
GNG2 P59768 1/20 0.37
GNB1 P62873 1/20 0.37

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
SCHEMBL28934003 0.84 BCHE (0.44) MEN1KMT2ASMN1; SMN2GAAALDH1A1
SCHEMBL29387666 0.84 BCHE (0.44) MEN1KMT2ASMN1; SMN2GAAALDH1A1
SCHEMBL31423808 0.83 GNG2 (0.49) MEN1KMT2AELANEMGLLSMN1; SMN2
SCHEMBL1264195 0.83 GNG2 (0.49) MEN1KMT2AELANEMGLLSMN1; SMN2
SCHEMBL28709693 0.82 CHRM1 (0.45) MEN1KMT2AGAAALDH1A1BCHE
Hydrochloric Acid SCHEMBL30544630 0.81 GNG2 (0.47) MEN1KMT2AELANEMGLLSMN1; SMN2
SCHEMBL24457995 0.80 ALDH1A1 (0.50) ELANEMGLLSMN1; SMN2GAAALDH1A1
SCHEMBL19842099 0.80 LMNA (0.43) MEN1KMT2AMGLLSMN1; SMN2GAA
SCHEMBL15470446 0.80 FAAH (0.47) MEN1KMT2AMGLLSMN1; SMN2GAA
SCHEMBL29387048 0.80 ALDH1A1 (0.50) ELANEMGLLSMN1; SMN2GAAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11692065-B2 Phenazine copolymers and uses thereof CORNELL UNIVERSITY (US) 2023-07-04 US disclosed