SCHEMBL31228783

SCHEMBL31228783

Clc1ccc2c(c1)sc1cc(Cl)ccc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCKDK O14874 1/20 0.53
MCL1 Q07820 1/20 0.53
RXFP1 Q9HBX9 1/20 0.53
KDM4E B2RXH2 5/20 0.45
MAPT P10636 5/20 0.45
ALDH1A1 P00352 5/20 0.45
KMT2A Q03164 4/20 0.45
GAA P10253 3/20 0.45
MEN1 O00255 3/20 0.45
GFER P55789 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
RAB9A P51151 4/20 0.42
NPC1 O15118 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.41
HPGD P15428 3/20 0.41
CYP2A6 P11509 2/20 0.40
LMNA P02545 3/20 0.39
ALOX12 P18054 1/20 0.39
HTT P42858 1/20 0.39
GPR3 P46089 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
SCHEMBL4922527 1.00 BCKDK (0.53) BCKDKMCL1RXFP1KDM4EMAPT
SCHEMBL22375225 0.95 BCKDK (0.50) BCKDKMCL1RXFP1KDM4EMAPT
SCHEMBL31012019 0.89 KDM4E (0.61) BCKDKMCL1RXFP1KDM4EMAPT
SCHEMBL15318107 0.89 KDM4E (0.61) BCKDKMCL1RXFP1KDM4EMAPT
SCHEMBL30406558 0.87 MIF (0.46) BCKDKMCL1RXFP1KDM4EMAPT
SCHEMBL4922476 0.87 BCKDK (0.49) BCKDKMCL1RXFP1KDM4EMAPT
SCHEMBL4919520 0.87 MIF (0.46) BCKDKMCL1RXFP1KDM4EMAPT
SCHEMBL4921439 0.87 BCKDK (0.44) BCKDKMCL1RXFP1KDM4EMAPT
SCHEMBL15223343 0.84 BCKDK (0.50) BCKDKMCL1RXFP1KDM4EMAPT
SCHEMBL22172191 0.83 CYP2A6 (0.48) BCKDKMCL1RXFP1KDM4EMAPT

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-118724884-A Organic luminescent material with blue and green light emission and preparation method thereof 平顶山金振高新材料有限公司 2024-10-01 CN disclosed