SCHEMBL22989181

SCHEMBL22989181

Clc1ccc(-c2nc(-c3cccc4c3sc3ccccc34)c3oc4ccccc4c3n2)c2ccccc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIM1 P11309 1/20 0.39
▸ CSNK2A2 P19784 1/20 0.39
▸ CSNK2B P67870 1/20 0.39
▸ PIM3 Q86V86 1/20 0.39
▸ PIM2 Q9P1W9 1/20 0.39
▸ PRKDC P78527 6/20 0.36
▸ PIK3CD O00329 2/20 0.36
▸ PIK3CB P42338 2/20 0.36
▸ KMT2A Q03164 5/20 0.34
▸ MEN1 O00255 4/20 0.34
▸ ALDH1A1 P00352 4/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ ALOX5 P09917 1/20 0.33
▸ MAPT P10636 4/20 0.32
▸ LMNA P02545 2/20 0.32
▸ POLB P06746 2/20 0.32
▸ HPGD P15428 2/20 0.32
▸ BRD4 O60885 1/20 0.32
▸ PIK3CA P42336 1/20 0.32

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
SCHEMBL18273216 0.85 PRKDC (0.40) PIM1CSNK2A2CSNK2BPIM3PIM2
SCHEMBL17297521 0.85 PIM1 (0.40) PIM1CSNK2A2CSNK2BPIM3PIM2
SCHEMBL31201803 0.85 PIM1 (0.40) PIM1CSNK2A2CSNK2BPIM3PIM2
SCHEMBL22989051 0.83 ALOX5 (0.38) PIM1PIM2PRKDCPIK3CDPIK3CB
SCHEMBL20659725 0.82 SMN1; SMN2 (0.44) PIM1CSNK2A2CSNK2BPIM3PIM2
SCHEMBL25016211 0.82 MAPT (0.41) PRKDCPIK3CDPIK3CBKMT2AMEN1
SCHEMBL18273210 0.81 MAPT (0.40) PRKDCPIK3CDPIK3CBKMT2AMEN1
SCHEMBL25017772 0.81 MAPT (0.40) PRKDCPIK3CDPIK3CBKMT2AMEN1
SCHEMBL25016616 0.81 MAPT (0.40) PRKDCPIK3CDPIK3CBKMT2AMEN1
SCHEMBL25017488 0.81 MAPT (0.40) PRKDCPIK3CDPIK3CBKMT2AMEN1

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-2021029757-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME 주식회사 엘지화학 2021-02-18 — — WO disclosed
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