SCHEMBL30740939

SCHEMBL30740939

CCOC(=O)c1c[nH]c(-c2cc(F)cc(F)c2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.42
CA1 P00915 3/20 0.42
CA2 P00918 3/20 0.42
CA7 P43166 3/20 0.42
CA9 Q16790 3/20 0.42
CA14 Q9ULX7 3/20 0.42
MAPT P10636 2/20 0.40
MEN1 O00255 1/20 0.40
CASP3 P42574 1/20 0.40
KMT2A Q03164 1/20 0.40
TRPV1 Q8NER1 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
GCGR P47871 1/20 0.40
MAPK14 Q16539 1/20 0.40
JAK2 O60674 1/20 0.40
JAK3 P52333 1/20 0.40
KDM4E B2RXH2 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL1156651 0.87 GCGR (0.53) MAPTMEN1CASP3KMT2ATRPV1
SCHEMBL30741072 0.86 JAK2 (0.52) MAPTMEN1KMT2AJAK2JAK3
SCHEMBL30741111 0.82 HDAC3 (0.41) CA12CA1CA2CA7CA9
SCHEMBL1156503 0.81 SMN1; SMN2 (0.54) MAPTMEN1KMT2AKDM4ENPC1
SCHEMBL4191460 0.78 CDC7 (0.60) KMT2AGCGRMAPK14IMPDH2LMNA
SCHEMBL29552309 0.78 ALPL (0.51) MAPTGCGRNPC1RAB9ASMN1; SMN2
SCHEMBL29551706 0.78 MAPT (0.47) MAPTMEN1KMT2AGCGRMAPK14
SCHEMBL1156007 0.77 L3MBTL1 (0.52) MAPTMEN1CASP3KMT2ASENP7
SCHEMBL1278441 0.77 CA12 (0.41) CA12CA1CA2CA7CA9
SCHEMBL1202702 0.77 CA12 (0.62) CA12CA1CA2CA7CA9

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-117396465-A Novel oxazole derivative for preventing or treating allergic diseases and pharmaceutical composition containing the same 阿斯克里斯有限公司 2024-01-12 CN disclosed