SCHEMBL28435178

SCHEMBL28435178

O=C(NNC(=S)NC(=O)c1ccccc1)c1ccc(Br)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 8/20 0.77
KMT2A Q03164 8/20 0.77
CCR6 P51684 1/20 0.72
RAB9A P51151 1/20 0.70
GAA P10253 6/20 0.69
ALDH1A1 P00352 2/20 0.69
LMNA P02545 1/20 0.69
UBE2N P61088 1/20 0.69
SMN1; SMN2 Q16637 1/20 0.69
EPHX1 P07099 1/20 0.68
CRHBP P24387 1/20 0.68
CRHR2 Q13324 1/20 0.68
NLRP3 Q96P20 1/20 0.68
KDM4E B2RXH2 1/20 0.64
ALPL P05186 1/20 0.62
ALPI P09923 1/20 0.62
ALPG P10696 1/20 0.62
CYP2C9 P11712 1/20 0.62

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
SCHEMBL11599578 0.90 KMT2A (0.86) MEN1KMT2ACCR6RAB9AGAA
SCHEMBL28432111 0.86 KMT2A (0.72) MEN1KMT2ACCR6RAB9AGAA
SCHEMBL1594360 0.86 RAB9A (0.68) MEN1KMT2ARAB9AGAAALDH1A1
SCHEMBL28442097 0.86 CCR6 (0.75) MEN1KMT2ACCR6GAAALDH1A1
SCHEMBL28438357 0.84 SMN1; SMN2 (0.66) MEN1KMT2ACCR6RAB9AGAA
SCHEMBL22429059 0.84 CCR6 (1.00) MEN1KMT2ACCR6GAAALDH1A1
SCHEMBL11064756 0.82 MEN1 (0.64) MEN1KMT2ARAB9AALDH1A1LMNA
SCHEMBL28439569 0.82 TLR7 (0.77) MEN1KMT2ARAB9AGAAALDH1A1
SCHEMBL28434652 0.81 KMT2A (1.00) MEN1KMT2AGAAALDH1A1LMNA
SCHEMBL28436333 0.81 KMT2A (1.00) MEN1KMT2AGAAALDH1A1LMNA

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-107041374-B Application of N-substituted aryl (arylformamido) -N' -substituted arylformyl thiourea compound in blue algae growth inhibition 华中师范大学 2020-05-05 CN disclosed