SCHEMBL21119791

SCHEMBL21119791

c1cnc2c(c1)ccc1ccc(-c3ccc(-c4ccc5c(ccc6sc7ccccc7c65)n4)cc3)nc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.40
CDK1 P06493 6/20 0.39
MAPKAPK2 P49137 6/20 0.39
TOP1 P11387 5/20 0.39
KDM4E B2RXH2 3/20 0.36
MAPT P10636 3/20 0.36
CYP3A4 P08684 3/20 0.36
CCR1 P32246 2/20 0.36
CCR5 P51681 2/20 0.36
CCR8 P51685 2/20 0.36
CYP2D6 P10635 2/20 0.36
GMNN O75496 1/20 0.36
TP53 P04637 1/20 0.36
HSP90AA1 P07900 1/20 0.36
MMP2 P08253 1/20 0.36
MMP9 P14780 1/20 0.36
ALOX15 P16050 1/20 0.36
TSHR P16473 1/20 0.36
NFKB1 P19838 1/20 0.36
MMP8 P22894 1/20 0.36

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
SCHEMBL21119937 0.92 LMNA (0.40) LMNACDK1MAPKAPK2TOP1KDM4E
SCHEMBL21119977 0.91 LMNA (0.40) LMNACDK1MAPKAPK2TOP1KDM4E
SCHEMBL21119794 0.91 LMNA (0.40) LMNACDK1MAPKAPK2TOP1KDM4E
SCHEMBL21119959 0.91 CDK1 (0.43) CDK1MAPKAPK2KDM4EMAPTCYP3A4
SCHEMBL21119683 0.88 LMNA (0.37) LMNACDK1MAPKAPK2TOP1KDM4E
SCHEMBL21119581 0.88 CCR1 (0.36) LMNATOP1KDM4EMAPTCYP3A4
SCHEMBL18845825 0.87 TOP1 (0.35) LMNACDK1MAPKAPK2TOP1KDM4E
SCHEMBL21120247 0.87 CDK1 (0.41) LMNACDK1MAPKAPK2KDM4EMAPT
SCHEMBL21119641 0.86 CDK1 (0.40) LMNACDK1MAPKAPK2KDM4EMAPT
SCHEMBL21119758 0.85 LMNA (0.40) LMNATOP1KDM4EMAPTCYP3A4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11522139-B2 Organic light emitting diode LG DISPLAY CO., LTD. (KR) 2022-12-06 US disclosed
US-20190207123-A1 ORGANIC LIGHT EMITTING DIODE LG CHEM, LTD. (KR) 2019-07-04 US disclosed