SCHEMBL21119681

SCHEMBL21119681

c1ccc2cc3c(-c4ccc5ccc6cccnc6c5n4)ccc(-c4ccc5c(ccc6c7ccccc7oc56)n4)c3cc2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.39
CYP1A2 P05177 4/20 0.37
CYP1B1 Q16678 3/20 0.37
CYP1A1 P04798 2/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
KDM4E B2RXH2 3/20 0.36
MAPT P10636 3/20 0.36
CYP3A4 P08684 2/20 0.36
CCR1 P32246 2/20 0.36
CCR5 P51681 2/20 0.36
CCR8 P51685 2/20 0.36
TSHR P16473 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
CYP2D6 P10635 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
SCHEMBL21119851 0.95 LMNA (0.42) LMNACYP1A2CYP1B1CYP1A1NPC1
SCHEMBL21119675 0.92 LMNA (0.41) LMNACYP1A2CYP1B1CYP1A1NPC1
SCHEMBL21120236 0.91 MAPK1 (0.36) LMNACYP1A2CYP1B1CYP1A1NPC1
SCHEMBL21119685 0.88 LMNA (0.38) LMNACYP1A2NPC1RAB9ACYP2C9
SCHEMBL21119771 0.87 LMNA (0.41) LMNACYP1A2CYP1B1CYP1A1NPC1
SCHEMBL21119906 0.87 LMNA (0.41) LMNACYP1A2CYP1B1CYP1A1NPC1
SCHEMBL21119987 0.87 ALOX5 (0.39) LMNACYP1A2CYP1B1CYP1A1NPC1
SCHEMBL21119998 0.86 LMNA (0.34) LMNACYP1A2NPC1RAB9ACYP2C9
SCHEMBL15393969 0.85 KDM4E (0.40) LMNACYP1A2CYP1B1CYP1A1NPC1
SCHEMBL21119691 0.85 ALDH1A1 (0.36) LMNACYP1A2CYP1B1CYP1A1KDM4E

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