SCHEMBL21119983

SCHEMBL21119983

c1cnc2c(c1)ccc1ccc(-c3ccc(-c4nc5ccc6sc7ccccc7c6c5c5ccccc45)cc3)nc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.36
KDM4E B2RXH2 3/20 0.33
MAPT P10636 3/20 0.33
CYP3A4 P08684 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
GMNN O75496 1/20 0.33
TP53 P04637 1/20 0.33
HSP90AA1 P07900 1/20 0.33
MMP2 P08253 1/20 0.33
CYP2D6 P10635 1/20 0.33
MMP9 P14780 1/20 0.33
ALOX15 P16050 1/20 0.33
TSHR P16473 1/20 0.33
NFKB1 P19838 1/20 0.33
MMP8 P22894 1/20 0.33
CCR1 P32246 1/20 0.33
THPO P40225 1/20 0.33
MTOR P42345 1/20 0.33
HTT P42858 1/20 0.33
MMP13 P45452 1/20 0.33

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
SCHEMBL21119969 0.90 CDK1 (0.33) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL21119804 0.88 LMNA (0.37) LMNAKDM4EMAPTCYP3A4SMN1; SMN2
SCHEMBL18845825 0.88 TOP1 (0.35) LMNAKDM4EMAPTCYP3A4SMN1; SMN2
SCHEMBL21119593 0.88 LMNA (0.36) LMNAKDM4EMAPTCYP3A4SMN1; SMN2
SCHEMBL21119893 0.88 LMNA (0.36) LMNAKDM4EMAPTCYP3A4SMN1; SMN2
SCHEMBL21119766 0.87 LMNA (0.36) LMNAKDM4EMAPTCYP3A4SMN1; SMN2
SCHEMBL21119802 0.85 LMNA (0.34) LMNAKDM4EMAPTCYP3A4SMN1; SMN2
SCHEMBL21119791 0.85 LMNA (0.40) LMNAKDM4EMAPTCYP3A4SMN1; SMN2
SCHEMBL21119759 0.84 CCR1 (0.36) LMNAKDM4EMAPTCYP3A4SMN1; SMN2
SCHEMBL21119695 0.83 KDM4E (0.33) KDM4EMAPTALDH1A1HPGD

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