SCHEMBL22337253

SCHEMBL22337253

Cc1ccc2cc3oc4ccc(Br)cc4c(=O)c3cc2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK2A2 P19784 1/20 0.50
CSNK2B P67870 1/20 0.50
CSNK2A1 P68400 1/20 0.50
MAPT P10636 3/20 0.45
TP53 P04637 1/20 0.45
CYP3A4 P08684 1/20 0.45
MAPK1 P28482 1/20 0.45
RECQL P46063 1/20 0.45
KMT2A Q03164 1/20 0.45
ALDH1A1 P00352 4/20 0.44
KDM4E B2RXH2 4/20 0.43
SMN1; SMN2 Q16637 4/20 0.43
LMNA P02545 1/20 0.43
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
HPGD P15428 2/20 0.43
CASP3 P42574 1/20 0.43
SENP8 Q96LD8 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
SENP6 Q9GZR1 1/20 0.43

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
SCHEMBL19217398 0.86 CSNK2A2 (0.62) CSNK2A2CSNK2BCSNK2A1MAPTTP53
SCHEMBL1992744 0.85 CSNK2A2 (0.55) CSNK2A2CSNK2BCSNK2A1MAPTTP53
SCHEMBL20317328 0.83 KMT2A (0.47) MAPTCYP3A4KMT2AALDH1A1KDM4E
SCHEMBL20317240 0.82 NPC1 (0.55) MAPTTP53CYP3A4KMT2AALDH1A1
SCHEMBL20317242 0.82 NPC1 (0.55) MAPTTP53CYP3A4KMT2AALDH1A1
SCHEMBL2628177 0.82 CSNK2A2 (0.58) CSNK2A2CSNK2BCSNK2A1MAPTTP53
SCHEMBL20317284 0.82 KDM4E (0.69) CSNK2A2CSNK2BCSNK2A1MAPTTP53
SCHEMBL20317282 0.82 KDM4E (0.69) CSNK2A2CSNK2BCSNK2A1MAPTTP53
SCHEMBL18327947 0.80 CYP2A6 (0.50) MAPTTP53CYP3A4MAPK1KMT2A
SCHEMBL18327957 0.80 CYP2A6 (0.50) MAPTTP53CYP3A4MAPK1KMT2A

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-2020162703-A1 NOVEL HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME 주식회사 엘지화학 2020-08-13 WO disclosed