SCHEMBL2334831

SCHEMBL2334831

COC(=O)[C@@H](C)Nc1ccc(F)c(F)c1F

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.49
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
NPC1 O15118 2/20 0.43
HTT P42858 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ALDH1A1 P00352 3/20 0.41
TDP1 Q9NUW8 1/20 0.39
TSHR P16473 1/20 0.39
KDM4E B2RXH2 1/20 0.39
HPGD P15428 1/20 0.39
EPHX2 P34913 4/20 0.38
FPR2 P25090 1/20 0.38
SCN9A Q15858 1/20 0.38
LMNA P02545 1/20 0.38
ALPL P05186 1/20 0.38
ALPI P09923 1/20 0.38
ALPG P10696 1/20 0.38

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
SCHEMBL2339438 1.00 POLB (0.49) POLBMEN1KMT2ANPC1HTT
SCHEMBL2337104 1.00 POLB (0.49) POLBMEN1KMT2ANPC1HTT
SCHEMBL2334589 0.86 POLB (0.44) POLBNPC1HTTRAB9ASMN1; SMN2
SCHEMBL2335553 0.86 POLB (0.44) POLBNPC1HTTRAB9ASMN1; SMN2
SCHEMBL2331257 0.86 POLB (0.44) POLBNPC1HTTRAB9ASMN1; SMN2
SCHEMBL2331584 0.83 ALDH1A1 (0.46) POLBNPC1HTTRAB9ASMN1; SMN2
SCHEMBL2331330 0.83 ALDH1A1 (0.46) POLBNPC1HTTRAB9ASMN1; SMN2
SCHEMBL2331329 0.83 ALDH1A1 (0.46) POLBNPC1HTTRAB9ASMN1; SMN2
SCHEMBL2331577 0.77 EPHX2 (0.51) POLBMEN1KMT2ANPC1RAB9A
Hydrochloric Acid SCHEMBL16059705 0.77 MEN1 (0.66) POLBMEN1KMT2ANPC1RAB9A

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-2360160-A1 Intermediates and their use for producing benzoxazine derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-08-24 EP disclosed