SCHEMBL11099229

SCHEMBL11099229

CCNC(CC)CNC(=O)c1c(O)c2ccccc2c2nc3ccccc3nc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TACR3 P29371 7/20 0.38
KDM4E B2RXH2 6/20 0.38
MEN1 O00255 6/20 0.38
KMT2A Q03164 6/20 0.38
ALDH1A1 P00352 2/20 0.38
TACR2 P21452 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
TACR1 P25103 1/20 0.38
CYP2C19 P33261 1/20 0.38
OPRM1 P35372 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
PKMYT1 Q99640 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
GLA P06280 2/20 0.36
MAPT P10636 2/20 0.36
NPSR1 Q6W5P4 2/20 0.35
GAA P10253 1/20 0.35

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
SCHEMBL11096759 0.86 TACR3 (0.39) TACR3KDM4EMEN1KMT2AALDH1A1
SCHEMBL11079267 0.77 KMT2A (0.40) KDM4EMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL11099466 0.77 MEN1 (0.39) TACR3KDM4EMEN1KMT2AALDH1A1
SCHEMBL11099295 0.76 TOP2A (0.43) KDM4EMEN1KMT2ACYP1A2CYP2D6
SCHEMBL11088487 0.76 MEN1 (0.51) KDM4EMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL11099232 0.75 KDM4E (0.51) KDM4EMEN1KMT2AALDH1A1CYP1A2
SCHEMBL11088483 0.74 KMT2A (0.42) TACR3KDM4EMEN1KMT2AALDH1A1
SCHEMBL10370567 0.74 KDM4E (0.44) KDM4EMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL11090325 0.73 KDM4E (0.48) KDM4EMEN1KMT2AALDH1A1CYP1A2
SCHEMBL11099225 0.73 TACR3 (0.41) TACR3KDM4EMEN1KMT2AALDH1A1

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-4472578-A Benzo[a]phenazine antimicrobials TAISHO PHARMACEUTICAL CO., LTD. (JP) 1984-09-18 US disclosed