SCHEMBL9564487

SCHEMBL9564487

CCOC(=O)c1cc(=O)c2cc(N)c(N3CCN(C)CC3)c(F)c2n1C1CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
MAPK10 P53779 1/20 0.38
ALDH1A1 P00352 3/20 0.37
TOP2A P11388 1/20 0.36
TOP2B Q02880 1/20 0.36
MAPK1 P28482 2/20 0.35
USP2 O75604 1/20 0.35
LMNA P02545 1/20 0.35
HTT P42858 1/20 0.35
KDM4E B2RXH2 1/20 0.35
TP53 P04637 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
CASP1 P29466 1/20 0.35
CASP7 P55210 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TRPV4 Q9HBA0 1/20 0.34
ADRB2 P07550 1/20 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
SCHEMBL9564502 0.92 MEN1 (0.39) MEN1KMT2AMAPK10ALDH1A1MAPK1
SCHEMBL9564450 0.86 MEN1 (0.40) MEN1KMT2AMAPK10ALDH1A1TOP2A
SCHEMBL9564459 0.86 MEN1 (0.40) MEN1KMT2AMAPK10ALDH1A1MAPK1
SCHEMBL9564469 0.82 LGMN (0.41) MEN1KMT2AMAPK10ALDH1A1LMNA
SCHEMBL23037281 0.81 TOP2A (0.47) KMT2AALDH1A1TOP2ATOP2BMAPK1
SCHEMBL9564509 0.81 MEN1 (0.38) MEN1KMT2AMAPK10ALDH1A1MAPK1
SCHEMBL9564504 0.80 RXFP1 (0.42) MEN1KMT2AALDH1A1KDM4EGRK6
SCHEMBL9564489 0.80 MEN1 (0.37) MEN1KMT2AMAPK10ALDH1A1MAPK1
SCHEMBL9564488 0.79 MEN1 (0.38) MEN1KMT2AMAPK10ALDH1A1LMNA
SCHEMBL9561861 0.78 ADRB2 (0.43) MEN1KMT2AALDH1A1TOP2ATOP2B

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-0531958-A1 6-Aminoquinolones, their synthesis and their use as antibacterial agents MEDIOLANUM FARMACEUTICI S.P.A. (IT) 1993-03-17 EP disclosed