SCHEMBL27358349

SCHEMBL27358349

Cc1cccc2c1COC(N[C@H](C)c1ccc(Br)cc1)=N2

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ELANE P08246 3/20 0.43
CTRB1 P17538 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
IDH1 O75874 5/20 0.34
P2RX3 P56373 1/20 0.31
EGFR P00533 1/20 0.31
POLB P06746 1/20 0.30

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
SCHEMBL27358351 1.00 ELANE (0.43) ELANECTRB1SMN1; SMN2KDM4EALDH1A1
SCHEMBL27363486 0.88 ELANE (0.32) ELANECTRB1
SCHEMBL27377429 0.83 ELANE (0.35) ELANECTRB1
SCHEMBL27379949 0.75 TAAR1 (0.37)
SCHEMBL27551816 0.72 ELANE (0.45) ELANECTRB1SMN1; SMN2KDM4EALDH1A1
SCHEMBL30122568 0.67 KDM4E (0.34) SMN1; SMN2KDM4EALDH1A1
SCHEMBL27362385 0.65 TAAR1 (0.37) SMN1; SMN2KDM4EALDH1A1HPGD
SCHEMBL6497235 0.60 ELANE (1.00) ELANECTRB1
SCHEMBL28667663 0.59 GAA (0.61) SMN1; SMN2KDM4EALDH1A1HPGDEGFR
SCHEMBL15137210 0.56 ALDH1A1 (0.62) SMN1; SMN2KDM4EALDH1A1EGFRPOLB

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
CN-1070480-C 2-amino-benzoxanones for the treatment of viral infections SEARLE & CO (US) 2001-09-05 CN disclosed