SCHEMBL6572362

SCHEMBL6572362

CCCCCCCCCCCCCC[N+](C)(C)Cc1cccc(Cl)c1Cl

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 7/20 0.53
KMT2A Q03164 3/20 0.51
MEN1 O00255 2/20 0.51
MAPK1 P28482 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
TP53 P04637 1/20 0.51
HTT P42858 5/20 0.50
HSP90AA1 P07900 2/20 0.45
RAD52 P43351 2/20 0.45
PSMD14 O00487 1/20 0.45
MMP2 P08253 1/20 0.45
MC4R P32245 1/20 0.45
PNMT P11086 1/20 0.42
MLNR O43193 1/20 0.41
NR1I2 O75469 1/20 0.41
ESR1 P03372 1/20 0.41
NR3C1 P04150 1/20 0.41
PGR P06401 1/20 0.41
ADRB2 P07550 1/20 0.41
CHRM2 P08172 1/20 0.41

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
SCHEMBL6543022 1.00 DNM1 (0.53) DNM1KMT2AMEN1MAPK1SMN1; SMN2
Hydrochloric Acid SCHEMBL8072098 0.98 KMT2A (0.54) DNM1KMT2AMEN1MAPK1SMN1; SMN2
Hydrochloric Acid SCHEMBL6576279 0.98 KMT2A (0.54) DNM1KMT2AMEN1MAPK1SMN1; SMN2
Hydrochloric Acid SCHEMBL6576294 0.98 KMT2A (0.54) DNM1KMT2AMEN1MAPK1SMN1; SMN2
Hydrochloric Acid SCHEMBL6576354 0.98 KMT2A (0.54) DNM1KMT2AMEN1MAPK1SMN1; SMN2
Hydrochloric Acid SCHEMBL11140883 0.86 KMT2A (0.61) DNM1KMT2AMEN1MAPK1SMN1; SMN2
SCHEMBL7132276 0.86 PNMT (0.43) DNM1KMT2AMEN1MAPK1SMN1; SMN2
Gluconic Acid SCHEMBL7614470 0.80 LMNA (0.39) DNM1KMT2AMEN1MAPK1SMN1; SMN2
Hydrochloric Acid SCHEMBL8720796 0.80 KMT2A (0.71) DNM1KMT2AMEN1MAPK1SMN1; SMN2
Hydrochloric Acid SCHEMBL7760973 0.80 KMT2A (0.71) DNM1KMT2AMEN1MAPK1SMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0764676-B1 Method of preparing polycarbonate-polysiloxane block copolymers GEN ELECTRIC (US) 2004-04-28 EP claimed