SCHEMBL23905794

SCHEMBL23905794

C=C(OC)/C(=N\CC)c1ccc(F)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.39
MAOB P27338 2/20 0.39
SMN1; SMN2 Q16637 3/20 0.38
LMNA P02545 1/20 0.38
PTBP1 P26599 1/20 0.38
POLB P06746 1/20 0.36
GAA P10253 1/20 0.36
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
MAPT P10636 3/20 0.35
NPC1 O15118 3/20 0.35
RAB9A P51151 3/20 0.35
HTT P42858 2/20 0.35
MAPK1 P28482 2/20 0.35
CASP3 P42574 1/20 0.35
TRPV1 Q8NER1 1/20 0.35
SENP7 Q9BQF6 1/20 0.35
KDM4E B2RXH2 1/20 0.35
USP2 O75604 1/20 0.35
TP53 P04637 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
SCHEMBL23904715 0.81 MAOA (0.38) MAOAMAOBSMN1; SMN2LMNAPTBP1
SCHEMBL23904804 0.81 MAOA (0.38) MAOAMAOBSMN1; SMN2LMNAPTBP1
SCHEMBL23958935 0.79 MAOA (0.37) MAOAMAOBSMN1; SMN2LMNAPTBP1
SCHEMBL18809492 0.70 LMNA (0.41) MAOAMAOBSMN1; SMN2LMNAPTBP1
SCHEMBL21013602 0.68 MAOA (0.45) MAOAMAOBSMN1; SMN2LMNAPTBP1
SCHEMBL18944664 0.67 ATM (0.42) SMN1; SMN2LMNAPTBP1POLBGAA
SCHEMBL28451524 0.65 MAOB (0.39) MAOAMAOBSMN1; SMN2LMNAPTBP1
SCHEMBL25488741 0.64 HDAC3 (0.37) MAOAMAOBSMN1; SMN2LMNAPTBP1
SCHEMBL30513041 0.64 CA1 (0.53) SMN1; SMN2POLBKMT2ANPC1RAB9A
SCHEMBL23958873 0.64 CES2 (0.41) MAOAMAOBPOLBMEN1KMT2A

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
WO-2021198981-A1 ANTIVIRAL COMPOUNDS AND USES THEREOF Janssen Biopharma, Inc. (US) 2021-10-07 WO disclosed