SCHEMBL29010084

SCHEMBL29010084

Cl[CH]c1cccc(Cl)c1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPP1R15A O75807 1/20 0.47
MELK Q14680 1/20 0.47
PPP1R15B Q5SWA1 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
TSHR P16473 3/20 0.44
ALDH1A1 P00352 4/20 0.42
PNMT P11086 2/20 0.41
CYP1A2 P05177 2/20 0.39
CYP2A6 P11509 1/20 0.39
KMT2A Q03164 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MEN1 O00255 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
LMNA P02545 3/20 0.38
PTGS2 P35354 1/20 0.38
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
NFKB1 P19838 1/20 0.37
TAAR1 Q96RJ0 1/20 0.37

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
SCHEMBL3302004 0.81 PPP1R15A (0.48) PPP1R15AMELKPPP1R15BNPSR1L3MBTL1
SCHEMBL16956463 0.80 L3MBTL1 (0.44) PPP1R15AMELKPPP1R15BNPSR1L3MBTL1
SCHEMBL575083 0.78
SCHEMBL40188 0.77 ALDH1A1 (0.65) PPP1R15AMELKPPP1R15BNPSR1L3MBTL1
SCHEMBL1547373 0.77 L3MBTL1 (0.46) PPP1R15AMELKPPP1R15BNPSR1L3MBTL1
SCHEMBL1128766 0.77 PPP1R15A (0.46) PPP1R15AMELKPPP1R15BNPSR1L3MBTL1
SCHEMBL30011286 0.77 ALDH1A1 (0.54) PPP1R15AMELKPPP1R15BNPSR1L3MBTL1
SCHEMBL95211 0.77 ALDH1A1 (0.54) PPP1R15AMELKPPP1R15BNPSR1L3MBTL1
SCHEMBL9127344 0.77 PPP1R15A (0.46) PPP1R15AMELKPPP1R15BNPSR1L3MBTL1
SCHEMBL16951940 0.77 L3MBTL1 (0.50) PPP1R15AMELKPPP1R15BNPSR1L3MBTL1

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-116003467-A Novel triphosphine compound and synthetic method and application thereof 惠州凯特立斯科技有限公司 2023-04-25 CN disclosed