SCHEMBL31180321

SCHEMBL31180321

Cn1c(=O)oc2cc(F)c(Br)cc21

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
PKM P14618 6/20 0.40
ALDH1A1 P00352 2/20 0.40
HPGD P15428 2/20 0.40
TSHR P16473 3/20 0.40
PSMD14 O00487 1/20 0.39
LMNA P02545 3/20 0.39
TP53 P04637 1/20 0.39
KDM4E B2RXH2 1/20 0.38
POLB P06746 1/20 0.38
GFER P55789 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
SCHEMBL782441 1.00 MEN1 (0.41) MEN1KMT2APKMALDH1A1HPGD
SCHEMBL17419138 0.93 MEN1 (0.41) MEN1KMT2APKMALDH1A1HPGD
SCHEMBL24982338 0.81 PKM (0.50) MEN1KMT2APKMALDH1A1HPGD
SCHEMBL30881275 0.81 ALDH1A1 (0.41) MEN1KMT2APKMALDH1A1HPGD
SCHEMBL16362387 0.81 ALDH1A1 (0.41) MEN1KMT2APKMALDH1A1HPGD
SCHEMBL19086642 0.80 JAK2 (0.33) MEN1KMT2APKMALDH1A1HPGD
SCHEMBL29455589 0.79 MEN1 (0.41) MEN1KMT2APKMALDH1A1HPGD
SCHEMBL748712 0.79 PKM (0.41) MEN1KMT2APKMALDH1A1HPGD
SCHEMBL24981077 0.79 MEN1 (0.41) MEN1KMT2APKMALDH1A1HPGD
SCHEMBL16362024 0.78 MAPK1 (0.40) MEN1KMT2APKMALDH1A1HPGD

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-2024222814-A1 CYP11B2 INHIBITOR COMPOUND, PHARMACEUTICAL COMPOSITION AND USE THEREOF 长春金赛药业有限责任公司 2024-10-31 WO disclosed