SCHEMBL24809341

SCHEMBL24809341

Cc1cc(C)cc(C(=O)Nc2c(C)ccc3c(Br)cccc23)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S1PR4 O95977 3/20 0.46
THRB P10828 1/20 0.43
RXFP1 Q9HBX9 2/20 0.42
TP53 P04637 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
MEN1 O00255 5/20 0.40
KMT2A Q03164 5/20 0.40
POLB P06746 2/20 0.39
KCNK3 O14649 1/20 0.39
KCNH2 Q12809 1/20 0.39
KCNK9 Q9NPC2 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
MAPT P10636 2/20 0.38
AKT1 P31749 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
ABCC9 O60706 1/20 0.38
ABCC8 Q09428 1/20 0.38
KCNJ11 Q14654 1/20 0.38

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
SCHEMBL24807592 0.86 SMN1; SMN2 (0.46) THRBRXFP1TP53SMN1; SMN2MEN1
SCHEMBL24810184 0.82 KMT2A (0.53) THRBRXFP1TP53SMN1; SMN2MEN1
SCHEMBL24809056 0.76 RXFP1 (0.60) RXFP1TP53SMN1; SMN2MEN1KMT2A
SCHEMBL24809363 0.68 DHODH (0.49) THRBMEN1KMT2APOLBMAPT
SCHEMBL12581572 0.67 GRM5 (0.57) S1PR4THRBSMN1; SMN2MEN1KMT2A
SCHEMBL30900918 0.67 MAPT (0.47) RXFP1TP53SMN1; SMN2MEN1KMT2A
SCHEMBL1817366 0.66 GRM5 (0.60) S1PR4TP53SMN1; SMN2MEN1KMT2A
SCHEMBL25944931 0.66 KCNJ11 (0.59) RXFP1MEN1KMT2APOLBMAPT
SCHEMBL2917557 0.65 PKM (0.60) S1PR4THRBSMN1; SMN2
SCHEMBL9523014 0.65 S1PR4 (0.69) S1PR4SMN1; SMN2KMT2APOLBHDAC6

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-2022267941-A1 ORGANOMETALLIC IRIDIUM COMPOUND 广东阿格蕾雅光电材料有限公司 2022-12-29 WO disclosed