SCHEMBL21119938

SCHEMBL21119938

c1cnc2c(c1)ccc1ccc(-c3cccc4c(-c5cc6ccc7c8ccccc8sc7c6c6ccccc56)cccc34)nc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.36
LMNA P02545 4/20 0.36
ALDH1A1 P00352 4/20 0.36
KDM4E B2RXH2 3/20 0.36
MEN1 O00255 2/20 0.36
OPRK1 P41145 2/20 0.36
KMT2A Q03164 2/20 0.36
ESR1 P03372 1/20 0.36
POLB P06746 1/20 0.36
AGTR1 P30556 1/20 0.36
OPRM1 P35372 1/20 0.36
OPRD1 P41143 1/20 0.36
CCR1 P32246 5/20 0.35
CCR8 P51685 5/20 0.35
CCR5 P51681 3/20 0.35
HTT P42858 3/20 0.35
TSHR P16473 3/20 0.35
HIF1A Q16665 2/20 0.35
ALOX15 P16050 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35

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
SCHEMBL21119835 0.97 CCR1 (0.36) MAPTLMNAALDH1A1KDM4EMEN1
SCHEMBL21119768 0.94 CCR1 (0.33) MAPTLMNAALDH1A1KDM4EMEN1
SCHEMBL21120145 0.88 ALOX5 (0.38) MAPTHTTALOX5L3MBTL1PDE10A
SCHEMBL21119917 0.87 CCR1 (0.35) MAPTLMNAALDH1A1KDM4EMEN1
SCHEMBL21119890 0.87 CCR1 (0.35) MAPTLMNAALDH1A1KDM4EMEN1
SCHEMBL21119763 0.86 LMNA (0.36) MAPTLMNAALDH1A1KDM4EMEN1
SCHEMBL21119607 0.84 LIMK1 (0.34) MAPTALOX5L3MBTL1
SCHEMBL21120232 0.84 LMNA (0.36) MAPTLMNAALDH1A1KDM4EMEN1
SCHEMBL21119677 0.83 LMNA (0.40) MAPTLMNAALDH1A1KDM4EMEN1
SCHEMBL21119948 0.83 ALOX5 (0.33) MAPTALOX5

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