SCHEMBL9798384

SCHEMBL9798384

CCCCCCCCN(CCCCCCCC)c1ccc(-c2ccc(C=Cc3ccc([N+](=O)[O-])c(F)c3)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.39
ALDH1A1 P00352 2/20 0.39
MEN1 O00255 1/20 0.39
LMNA P02545 1/20 0.39
KMT2A Q03164 1/20 0.39
ALDH3A1 P30838 2/20 0.38
INSR P06213 1/20 0.37
CYP3A4 P08684 1/20 0.37
MAPK1 P28482 1/20 0.37
CHRM2 P08172 1/20 0.36
CHRM4 P08173 1/20 0.36
CHRM5 P08912 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 1/20 0.36
ATM Q13315 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
VCAM1 P19320 1/20 0.35
ATG4B Q9Y4P1 1/20 0.35
KDM4A O75164 2/20 0.34
KDM2A Q9Y2K7 2/20 0.34

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
SCHEMBL9798637 1.00 MAPT (0.39) MAPTALDH1A1MEN1LMNAKMT2A
SCHEMBL9798642 1.00 MAPT (0.39) MAPTALDH1A1MEN1LMNAKMT2A
SCHEMBL9798711 1.00 MAPT (0.39) MAPTALDH1A1MEN1LMNAKMT2A
SCHEMBL9798511 1.00 MAPT (0.39) MAPTALDH1A1MEN1LMNAKMT2A
SCHEMBL9798348 1.00 MAPT (0.39) MAPTALDH1A1MEN1LMNAKMT2A
SCHEMBL9798376 1.00 MAPT (0.39) MAPTALDH1A1MEN1LMNAKMT2A
SCHEMBL9798635 1.00 MAPT (0.39) MAPTALDH1A1MEN1LMNAKMT2A
SCHEMBL9798719 1.00 MAPT (0.39) MAPTALDH1A1MEN1LMNAKMT2A
SCHEMBL9798341 1.00 MAPT (0.39) MAPTALDH1A1MEN1LMNAKMT2A
SCHEMBL9798674 1.00 MAPT (0.39) MAPTALDH1A1MEN1LMNAKMT2A

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-0411103-A1 NON-LINEAR OPTICAL MATERIALS WITH VICINAL DONOR OR ACCEPTOR GROUPS MERCK PATENT GmbH (DE) 1991-02-06 EP disclosed
WO-1990009616-A1 NON-LINEAR OPTICAL MATERIALS WITH VICINAL DONOR OR ACCEPTOR GROUPS MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1990-08-23 WO disclosed